SCHEMBL1758540

SCHEMBL1758540

Cc1ccc(Cl)cc1NC=O

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.50
GAA P10253 3/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 3/20 0.46
KMT2A Q03164 1/20 0.45
TSHR P16473 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL7529692 0.84 MAPK1 (0.50) RAPGEF4GAAPOLBALDH1A1MAPT
SCHEMBL11412614 0.84 MAPK1 (0.50) RAPGEF4GAAPOLBALDH1A1MAPT
SCHEMBL3521701 0.80 LMNA (0.42) RAPGEF4GAAPOLBALDH1A1LMNA
SCHEMBL21131224 0.80 RAPGEF4 (0.50) RAPGEF4GAAPOLBALDH1A1LMNA
SCHEMBL1758619 0.79 MEN1 (0.50) RAPGEF4GAAPOLBALDH1A1LMNA
SCHEMBL1758631 0.79 MEN1 (0.50) RAPGEF4POLBALDH1A1MAPTKMT2A
SCHEMBL9597648 0.78 ALDH1A1 (0.41) POLBALDH1A1LMNAMAPTKMT2A
SCHEMBL1758405 0.76 PKM (0.42) GAAPOLBALDH1A1LMNAMAPT
SCHEMBL18228323 0.76 MEN1 (0.37) RAPGEF4GAAALDH1A1LMNAMAPT
SCHEMBL14606572 0.76 MAPK1 (0.33) RAPGEF4GAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
US-4034043-A PRODUCTION OF 2-AMINO-5-CHLORO-TOLUENE HYDROCHLORIDE CIBA-GEIGY CORPORATION (US) 1977-07-05 US claimed
EP-3359542-B1 SPIRO[3H-INDOLE-3,2´-PYRROLIDIN]-2(1H)-ONE COMPOUNDS AND DERIVATIVES AS MDM2-P53 INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-03-17 EP disclosed
EP-2684880-B1 DISPIROPYRROLIDINE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2018-02-28 EP disclosed
US-20180036296-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA COR THERAPEUTICS, INC. 2018-02-08 US disclosed
US-9629831-B2 Benzamides and related inhibitors of factor XA MILLENNIUM PHARMACEUTICALS, INC. (US) 2017-04-25 US disclosed
US-20160317511-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA COR THERAPEUTICS, INC. 2016-11-03 US disclosed
US-9108922-B2 Benzamides and related inhibitors of factor Xa MILLENNIUM PHARMACEUTICALS, INC. (US) 2015-08-18 US disclosed
US-20140377247-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-12-25 US disclosed
EP-2493886-B1 HETEROARYL PIPERIDINE AND PIPERAZINE DERIVATES BAYER CROPSCIENCE AG (DE) 2014-11-26 EP disclosed
WO-2011051244-A1 HETEROARYLPIPERIDINE AND -PIPERAZINE DERIVATIVES BAYER CROPSCIENCE AG (DE) 2011-05-05 WO disclosed
US-20100298284-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA MILLENNIUM PHARMACEUTICALS, INC. 2010-11-25 US disclosed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP disclosed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US disclosed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO disclosed
US-4034043-A PRODUCTION OF 2-AMINO-5-CHLORO-TOLUENE HYDROCHLORIDE CIBA-GEIGY CORPORATION (US) 1977-07-05 US disclosed
US-4034043-A PRODUCTION OF 2-AMINO-5-CHLORO-TOLUENE HYDROCHLORIDE CIBA-GEIGY CORPORATION (US) 1977-07-05 US disclosed
US-4034043-A PRODUCTION OF 2-AMINO-5-CHLORO-TOLUENE HYDROCHLORIDE CIBA-GEIGY CORPORATION (US) 1977-07-05 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 (4 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-20160317511-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA TFPI, F12, TFPI2 RAPGEF4 3217/4885GAA 209/4885POLB 2792/4885
US-20100298284-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA TFPI, F12, TFPI2 RAPGEF4 3217/4885GAA 209/4885POLB 2792/4885
US-20180036296-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA TFPI, F12, TFPI2 RAPGEF4 3217/4885GAA 209/4885POLB 2792/4885
US-20140377247-A1 BENZAMIDES AND RELATED INHIBITORS OF FACTOR XA TFPI, F12, TFPI2 RAPGEF4 3217/4885GAA 209/4885POLB 2792/4885

“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.