SCHEMBL6756097

SCHEMBL6756097

O=c1cc(-c2ccccc2)cc(-c2ccccc2)[nH]1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS2R38 P59533 1/20 0.60
NOTUM Q6P988 2/20 0.57
KDM4E B2RXH2 3/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
GPR84 Q9NQS5 1/20 0.49
HPGD P15428 3/20 0.48
HSD17B10 Q99714 2/20 0.48
ALDH1A1 P00352 1/20 0.48
CTSV O60911 1/20 0.48
LMNA P02545 1/20 0.48
TUBB4A P04350 1/20 0.48
TP53 P04637 1/20 0.48
TUBB P07437 1/20 0.48
CTSL P07711 1/20 0.48
TUBA3C P0DPH7 1/20 0.48
TUBA1B P68363 1/20 0.48
TUBA4A P68366 1/20 0.48
TUBB4B P68371 1/20 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
SCHEMBL19955621 0.89 ALDH1A1 (0.52) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8987066 0.89 HPGD (0.51) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8987070 0.89 CTSV (0.51) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8799713 0.89 HPGD (0.51) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL6762114 0.89 CTSV (0.51) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8987106 0.89 CYP1A2 (0.52) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8987311 0.89 CYP1A2 (0.52) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8987193 0.86 CYP19A1 (0.53) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8987203 0.85 KIF11 (0.56) TAS2R38NOTUMKDM4EGAAMAPT
SCHEMBL8986985 0.85 KDM4E (0.59) KDM4EMAPTTDP1GPR84HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190044076-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-02-07 US disclosed
EP-3016169-B1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO LTD (KR) 2017-01-11 EP disclosed
US-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES ELECTROPHORETICS LIMITED (GB) 2016-12-08 US disclosed
WO-2016068460-A1 ORGANIC OPTOELECTRONIC ELEMENT AND DISPLAY DEVICE 삼성에스디아이 주식회사 2016-05-06 WO disclosed
WO-2016068446-A1 ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2016-05-06 WO disclosed
US-20160126471-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-05-05 US disclosed
US-20160126471-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2016-05-05 US disclosed
EP-3016169-A1 ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE Samsung SDI Co., Ltd. (KR) 2016-05-04 EP disclosed
US-9136481-B2 Compound for an organic photoelectric device, organic photoelectric device including the same, and display device including the organic photoelectric device CHEIL INDUSTRIES, INC. (KR) 2015-09-15 US disclosed
US-9136481-B2 Compound for an organic photoelectric device, organic photoelectric device including the same, and display device including the organic photoelectric device CHEIL INDUSTRIES, INC. (KR) 2015-09-15 US disclosed
WO-2002036173-A2 SIMULTANEOUS DUAL ISOTOPE IMAGING OF CARDIAC PERFUSION AND CARDIAC INFLAMMATION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2002-05-10 WO disclosed
EP-0999856-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION Du Pont Pharmaceuticals Company (US) 2000-05-17 EP disclosed
CN-1239895-A Radiopharmaceuticals for imaging sites of infection and inflammation DU PONT MERCK PHARMA (US) 1999-12-29 CN disclosed
WO-1998015295-A2 RADIOPHARMACEUTICALS FOR IMAGING INFECTION AND INFLAMMATION DUPONT PHARMACEUTICALS COMPANY (US) 1998-04-16 WO disclosed
EP-0755381-A1 SUBSTITUTED PYRIDINE LEUKOTRIENE B 4 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 1997-01-29 EP disclosed
US-5492915-A ANTIINFLAMMATORY AGENTS RHONE-POULENC RORER S.A. (FR) 1996-02-20 US disclosed
WO-1995028386-A1 SUBSTITUTED PYRIDINE LEUKOTRIENE B4 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 1995-10-26 WO disclosed
US-5366982-A Antiinflammatory agents or antihistamines RHONE-POULENC RORER S.A. (FR) 1994-11-22 US disclosed
EP-0540604-A1 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS Aventis Pharma S.A. (FR) 1993-05-12 EP disclosed
WO-1992001675-A2 SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B4 ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS RHONE-POULENC RORER S.A. (FR) 1992-02-06 WO 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 (2 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-20190044076-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING THE SAME OR10J3, RER1, ORC3 TAS2R38 299/4885NOTUM 1543/4885KDM4E 2449/4885
US-20160354375-A1 CASEIN KINASE 1delta (CK 1delta) INHIBITORS AND THEIR USE IN THE TREATMENT OF NEURODEGENERATIVE DISEASES SUCH AS TAUOPATHIES CSNK1G1, CSNK1A1, CSNK1D TAS2R38 4678/4885NOTUM 2040/4885KDM4E 1514/4885

“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.