SCHEMBL2605622

SCHEMBL2605622

Cc1ccc(/C=C/c2ccc(Br)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.68
NFE2L2 Q16236 4/20 0.58
RAB9A P51151 2/20 0.56
CYP2C19 P33261 2/20 0.56
KDM4E B2RXH2 1/20 0.56
HPGD P15428 1/20 0.56
RELA Q04206 1/20 0.54
PTGS1 P23219 2/20 0.50
PTGS2 P35354 2/20 0.50
ALOX5 P09917 1/20 0.50
TUBB4A P04350 2/20 0.48
TUBB P07437 2/20 0.48
TUBA3C P0DPH7 2/20 0.48
TUBA1B P68363 2/20 0.48
TUBA4A P68366 2/20 0.48
TUBB4B P68371 2/20 0.48
TUBB3 Q13509 2/20 0.48
TUBB2A Q13885 2/20 0.48
TUBB8 Q3ZCM7 2/20 0.48
TUBA3E Q6PEY2 2/20 0.48

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14267407 1.00 ALDH1A1 (0.68) ALDH1A1NFE2L2RAB9ACYP2C19KDM4E
SCHEMBL28649356 1.00 ALDH1A1 (0.68) ALDH1A1NFE2L2RAB9ACYP2C19KDM4E
SCHEMBL6760777 1.00 ALDH1A1 (0.68) ALDH1A1NFE2L2RAB9ACYP2C19KDM4E
SCHEMBL2622599 0.90 ALDH1A1 (0.62) ALDH1A1NFE2L2RAB9ACYP2C19KDM4E
SCHEMBL4316553 0.87 ALDH1A1 (0.52) ALDH1A1NFE2L2RAB9ACYP2C19KDM4E
SCHEMBL18567985 0.87 ALDH1A1 (0.52) ALDH1A1NFE2L2RAB9ACYP2C19KDM4E
SCHEMBL14584900 0.87 ALDH1A1 (0.52) ALDH1A1NFE2L2RAB9ACYP2C19KDM4E
SCHEMBL3373054 0.86 ALDH1A1 (0.61) ALDH1A1RAB9ACYP2C19KDM4EHPGD
SCHEMBL9679607 0.86 ALDH1A1 (0.61) ALDH1A1RAB9ACYP2C19KDM4EHPGD
SCHEMBL9679616 0.86 ALDH1A1 (0.61) ALDH1A1RAB9ACYP2C19KDM4EHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9709906-B2 Charge transport substance, electrophotographic photoreceptor, electrophotographic photoreceptor cartridge, and image-forming apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2017-07-18 US disclosed
US-9709906-B2 Charge transport substance, electrophotographic photoreceptor, electrophotographic photoreceptor cartridge, and image-forming apparatus MITSUBISHI CHEMICAL CORPORATION (JP) 2017-07-18 US disclosed
US-9318706-B2 Laminated structure, method for producing same, and electronic element comprising same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-04-19 US disclosed
US-20150355559-A1 CHARGE TRANSPORT SUBSTANCE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE-FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2015-12-10 US disclosed
US-20150355559-A1 CHARGE TRANSPORT SUBSTANCE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE-FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2015-12-10 US disclosed
US-20140065532-A1 CHARGE TRANSPORT SUBSTANCE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE-FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2014-03-06 US disclosed
US-20140065532-A1 CHARGE TRANSPORT SUBSTANCE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE-FORMING APPARATUS MITSUBISHI CHEMICAL CORPORATION (JP) 2014-03-06 US disclosed
EP-2698671-A1 CHARGE-TRANSPORTING SUBSTANCE, ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY, ELECTROPHOTOGRAPHIC PHOTOSENSITIVE BODY CARTRIDGE, AND IMAGING DEVICE Mitsubishi Chemical Corporation (JP) 2014-02-19 EP disclosed
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 US disclosed
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2012-06-21 US disclosed
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-06-24 US disclosed
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2010-06-24 US disclosed
US-20080303019-A1 Side Chain-Containing Type Organic Silane Compound, Thin Film Transistor and Method of Producing Thereof SHARP KABUSHIKI KAISHA (JP) 2008-12-11 US disclosed
US-20070287848-A1 Silicon Compound Containi-Electron Conjugated-System Molecule and Process for Producing the Same SHARP KABUSHIKI KAISHA (JP) 2007-12-13 US disclosed
US-20070142671-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD (JP) 2007-06-21 US disclosed
US-20070142671-A1 ORGANIC ELECTROLUMESCENCE DEVICE IDEMITSU KOSAN CO., LTD (JP) 2007-06-21 US disclosed
US-6821644-B2 BIS(DIARYLAMINO)ARYLENE COMPOUND; BRILLIANCE, DURABILITY SAMSUNG SDI CO., LTD. (KR) 2004-11-23 US disclosed
US-4335055-A Process for the preparation of alkenylbenzene derivatives or alkenylnaphthalene derivatives CIBA-GEIGY CORPORATION (US) 1982-06-15 US disclosed
EP-0041043-A1 Process for the preparation of derivatives of alkenyl benzene or alkenyl naphthalene CIBA-GEIGY AG (CH) 1981-12-02 EP disclosed
US-4153719-A Aromatic diketones STERLING DRUG INC. (US) 1979-05-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070287848-A1 Silicon Compound Containi-Electron Conjugated-System Molecule and Process for Producing the Same SEM1, F12, ESPL1 ALDH1A1 1828/4885NFE2L2 2456/4885RAB9A 602/4885
US-20080303019-A1 Side Chain-Containing Type Organic Silane Compound, Thin Film Transistor and Method of Producing Thereof CBX3, SOS1, AOX1 ALDH1A1 425/4885NFE2L2 1886/4885RAB9A 1109/4885
US-20100160687-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 ALDH1A1 2388/4885NFE2L2 253/4885RAB9A 3241/4885
US-20120153815-A1 ORGANIC ELECTROLUMINESCENCE DEVICE ARL1, RIF1, EML4 ALDH1A1 699/4885NFE2L2 611/4885RAB9A 1808/4885
US-20070142671-A1 ORGANIC ELECTROLUMESCENCE DEVICE SCO2, CHRM1, CHRM4 ALDH1A1 2388/4885NFE2L2 253/4885RAB9A 3241/4885
US-20150355559-A1 CHARGE TRANSPORT SUBSTANCE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, ELECTROPHOTOGRAPHIC PHOTORECEPTOR CARTRIDGE, AND IMAGE-FORMING APPARATUS PDE6C, SLC18A2, SLC1A2 ALDH1A1 1118/4885NFE2L2 809/4885RAB9A 2358/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.