SCHEMBL9906994

SCHEMBL9906994

Cc1ccc2cccc(Nc3ccccc3)c2c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.65
CDC25B P30305 2/20 0.65
TP53 P04637 2/20 0.65
ALDH1A1 P00352 1/20 0.65
CYP3A4 P08684 1/20 0.65
ALOX15 P16050 1/20 0.65
TSHR P16473 1/20 0.65
ATM Q13315 1/20 0.65
HSD17B10 Q99714 1/20 0.65
TDP1 Q9NUW8 3/20 0.55
MAPT P10636 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
KDM4E B2RXH2 2/20 0.55
GAA P10253 2/20 0.55
GLA P06280 1/20 0.55
RECQL P46063 1/20 0.55
CYP2A6 P11509 2/20 0.52
CYP1A2 P05177 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52

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
SCHEMBL29260281 0.85 TRPV1 (0.52) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL25174770 0.85 ADRA2A (0.50) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL21525100 0.84 CDC25B (0.67) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL3403976 0.81 ALDH1A1 (0.73) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL2582572 0.81 CDC25B (0.67) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL30074722 0.81 CDC25B (0.67) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL30575369 0.80 CDC25B (0.71) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL1009448 0.80 CDC25B (0.71) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL9880989 0.79 ALDH1A1 (0.65) HPGDCDC25BTP53ALDH1A1CYP3A4
SCHEMBL18134974 0.79 RAB9A (0.53) HPGDCDC25BTP53ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230242831-A1 LOW FRICTION AND LOW TRACTION LUBRICANT COMPOSITIONS USEFUL IN DRY CLUTCH MOTORCYCLES ExxonMobil Technology and Engineering Company (US) 2023-08-03 US disclosed
US-20180171253-A1 COMPOSITION AND METHOD FOR PREVENTING OR REDUCING ENGINE KNOCK AND PRE-IGNITION IN HIGH COMPRESSION SPARK IGNITION ENGINES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2018-06-21 US disclosed
US-20180057769-A1 METHOD AND COMPOSITION FOR PREVENTING OR REDUCING ENGINE KNOCK AND PRE-IGNITION IN HIGH COMPRESSION SPARK IGNITION ENGINES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2018-03-01 US disclosed
US-20170009179-A1 COMPOSITION AND METHOD FOR PREVENTING OR REDUCING ENGINE KNOCK AND PRE-IGNITION IN HIGH COMPRESSION SPARK IGNITION ENGINES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2017-01-12 US disclosed
US-20170009169-A1 COMPOSITION AND METHOD FOR PREVENTING OR REDUCING ENGINE KNOCK AND PRE-IGNITION IN HIGH COMPRESSION SPARK IGNITION ENGINES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2017-01-12 US disclosed
US-9054321-B2 Heterocyclic compound and organic light-emitting device containing the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-06-09 US disclosed
US-8623795-B2 Method for maintaining antiwear performance of turbine oils containing polymerized amine antioxidants and for improving the deposit formation resistance performance of turbine oils containing monomeric and/or polymeric antioxidants EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2014-01-07 US disclosed
US-20130092903-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-04-18 US disclosed
US-RE43560-E1 Positive photosensitive compositions FUJIFILM CORPORATION (JP) 2012-07-31 US disclosed
US-20120142567-A1 METHOD FOR MAINTAINING ANTIWEAR PERFORMANCE OF TURBINE OILS CONTAINING POLYMERIZED AMINE ANTIOXIDANTS AND FOR IMPROVING THE DEPOSIT FORMATION RESISTANCE PERFORMANCE OF TURBINE OILS CONTAINING MONOMERIC AND/OR POLYMERIC ANTIOXIDANTS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2012-06-07 US disclosed
US-20120028861-A1 METHOD FOR IMPROVING THE DEPOSIT FORMATION RESISTANCE PERFORMANCE OF TURBINE OILS CONTAINING AMINE ANTIOXIDANTS EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2012-02-02 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 (1 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-20130092903-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE CONTAINING THE SAME CRY1, TRPC1, CYP1A1 HPGD 1004/4885CDC25B 1577/4885TP53 3747/4885

“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.