SCHEMBL9917124

SCHEMBL9917124

Cc1ccc(-c2cccc3c2sc2ccccc23)c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.52
ALOX5 P09917 1/20 0.49
CYP1A2 P05177 2/20 0.45
GPR3 P46089 1/20 0.43
PRKDC P78527 6/20 0.43
MAPT P10636 3/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
ALDH1A1 P00352 2/20 0.42
HCRTR1 O43613 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
KDM4E B2RXH2 2/20 0.40
PABPC1 P11940 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CYP2A6 P11509 1/20 0.40
PIK3CD O00329 2/20 0.39
PIK3CB P42338 2/20 0.39
BRD4 O60885 1/20 0.39
PIK3CA P42336 1/20 0.39
MTOR P42345 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
SCHEMBL13658622 0.87 L3MBTL1 (0.47) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL16437714 0.86 PARP14 (0.55) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL16553319 0.85 ALOX5 (0.61) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL21742792 0.84 PARP14 (0.54) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL22104930 0.84 PARP14 (0.56) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL429382 0.83 ALOX5 (0.59) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL431845 0.83 ALOX5 (0.59) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL10018846 0.83 ALOX5 (0.59) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL12996528 0.83 ALOX5 (0.59) PARP14ALOX5GPR3PRKDCMAPT
SCHEMBL18518758 0.82 PARP14 (0.49) PARP14ALOX5GPR3PRKDCMAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
WO-2021214348-A2 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2021-10-28 WO disclosed
US-9614160-B2 Aromatic amine derivatives and organic electroluminescent elements using same IDEMITSU KOSAN CO., LTD. (JP) 2017-04-04 US disclosed
US-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2016-03-03 US disclosed
US-9260390-B2 Aromatic amine derivatives and organic electroluminescent elements using same IDEMITSU KOSAN CO., LTD. (JP) 2016-02-16 US disclosed
US-20120146014-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2012-06-14 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 (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-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP2E1, GPX1, ERCC1 PARP14 3423/4885ALOX5 2648/4885CYP1A2 46/4885
US-20120146014-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 PARP14 2222/4885ALOX5 1407/4885CYP1A2 1383/4885
US-20160064669-A1 AROMATIC AMINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT ELEMENTS USING SAME PNMT, TYR, AOC2 PARP14 2222/4885ALOX5 1407/4885CYP1A2 1383/4885

“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.