SCHEMBL7102517

SCHEMBL7102517

CCc1ccc(-c2ccc(I)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.48
TP53 P04637 2/20 0.43
UCHL1 P09936 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CYP3A4 P08684 2/20 0.41
IDO1 P14902 2/20 0.41
CYP2A6 P11509 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
METAP2 P50579 1/20 0.41
NISCH Q9Y2I1 1/20 0.39
APP P05067 1/20 0.39
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL80820 0.92
Ammonia Solution, Strong SCHEMBL11898566 0.89 TP53 (0.48) EGFRTP53TAAR1CYP3A4IDO1
SCHEMBL1702558 0.86 TP53 (0.56) EGFRTP53UCHL1TAAR1CYP2A6
SCHEMBL2776957 0.86 TP53 (0.56) EGFRTP53UCHL1TAAR1CYP2A6
SCHEMBL12824293 0.84 TAAR1 (0.54) EGFRTP53TAAR1CYP3A4IDO1
SCHEMBL28148780 0.82 TP53 (0.42) EGFRTP53TAAR1CYP3A4IDO1
SCHEMBL15643365 0.80 LPL (0.45) HRH3LPLLIPGNISCH
SCHEMBL15161136 0.79 TP53 (0.43) EGFRTP53UCHL1TAAR1CYP2A6
SCHEMBL16705595 0.78 APP (0.50) CYP3A4IDO1APP
Acetic Acid SCHEMBL27547305 0.78 ALDH1A1 (0.56) EGFRTP53LPLLIPGALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212135-A1 LIGHT EMITTING ELEMENT, AMINE COMPOUND FOR THE SAME, AND DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-06 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-20110177312-A1 LAMINATED STRUCTURE, METHOD FOR PRODUCING SAME, AND ELECTRONIC ELEMENT COMPRISING SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-21 US disclosed
WO-2007053725-A2 NOVEL 1,4-BENZODIAZEPINE-2,5-DIONES WITH THERAPEUTIC PROPERTIES THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2007-05-10 WO disclosed
US-6528657-B2 For use in electroluminescence light emission element and can emit lights of various colors when an energy such as electric energy or electromagnetic energy is applied thereto TAIHO INDUSTRIES CO., LTD. (JP) 2003-03-04 US disclosed
US-20030023099-A1 Novel fluorescent carbazole derivative HIROSE ENGINEERING CO., LTD. (JP) 2003-01-30 US disclosed
EP-0757035-B1 Phenanthrylenediamine derivative and electrophotosensitive material using the same KYOCERA MITA CORP (JP) 2002-12-04 EP disclosed
EP-0799818-B1 Benzidine derivatives and electrophotosensitive material using the same KYOCERA MITA CORP (JP) 2002-05-02 EP disclosed
EP-0713148-B1 Naphthylenediamine derivative and electrophotosensitive material using the same KYOCERA MITA CORP (JP) 2002-03-13 EP disclosed
EP-1095931-A1 Benzidine derivatives and electrophotosensitive material using the same KYOCERA MITA CORPORATION (JP) 2001-05-02 EP disclosed
EP-0799818-A2 Benzidine derivatives and electrophotosensitive material using the same MITA INDUSTRIAL CO. LTD. (JP) 1997-10-08 EP disclosed
US-5616441-A AS ELECTRON TRANSFERRING COMPOUND; INCREASED PHOTOSENSITIVITY; WEAR AND HEAT RESISTANCE; SOLVENT SOLUBILITY; BINDER COMPATABILITY; COPIERS; LASER PRINTERS MITA INDUSTRIAL CO., LTD. (JP) 1997-04-01 US disclosed
EP-0757035-A1 Phenanthrylenediamine derivative and electrophotosensitive material using the same MITA INDUSTRIAL CO., LTD. (JP) 1997-02-05 EP disclosed
US-5550290-A CHARGE TRANSFER COMPOUND MITA INDUSTRIAL CO. LTD. (JP) 1996-08-27 US disclosed
EP-0718298-A1 Electron transporting tryptoanthrinime derivatives MITA INDUSTRIAL CO. LTD. (JP) 1996-06-26 EP disclosed
EP-0716078-A1 2-Ethyl-3,5,7-trinitrofluorenonimine derivative and use as charge transport MITA INDUSTRIAL CO. LTD. (JP) 1996-06-12 EP disclosed
EP-0713148-A1 Naphthylenediamine derivative and electrophotosensitive material using the same MITA INDUSTRIAL CO. LTD. (JP) 1996-05-22 EP disclosed
EP-0708375-A1 Tryptanthrine derivative and electrophotosensitive material MITA INDUSTRIAL CO., LTD. (JP) 1996-04-24 EP disclosed
US-5494765-A Electrophotosensitive material using a phenylenediamine derivative MITA INDUSTRIAL CO. LTD (JP) 1996-02-27 US disclosed
EP-0648737-A1 Benzidine derivatives and electrophotosensitive material using the same MITA INDUSTRIAL CO. LTD. (JP) 1995-04-19 EP 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 (3 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-20110177312-A1 LAMINATED STRUCTURE, METHOD FOR PRODUCING SAME, AND ELECTRONIC ELEMENT COMPRISING SAME EPCAM, ITGA1, ITGB1 EGFR 1908/4885TP53 3701/4885UCHL1 3229/4885
US-20230212135-A1 LIGHT EMITTING ELEMENT, AMINE COMPOUND FOR THE SAME, AND DISPLAY DEVICE INCLUDING THE SAME SLC1A2, SLC18A2, SLC18A1 EGFR 1635/4885TP53 4864/4885UCHL1 3016/4885
US-20030023099-A1 Novel fluorescent carbazole derivative CBR3, AANAT, SIRT3 EGFR 3458/4885TP53 3073/4885UCHL1 2151/4885

“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.