SCHEMBL7360209

SCHEMBL7360209

CNCC(=O)OCc1ccccc1.O=C(O)C(Cc1cccnc1)NS(=O)(=O)Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 4/20 0.45
ITGB3 P05106 3/20 0.45
ITGA2B P08514 2/20 0.45
CTSB P07858 1/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
CMKLR2 P46091 1/20 0.41
CMKLR1 Q99788 1/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NAMPT P43490 1/20 0.40
ITGAV P06756 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADAMTS4 O75173 1/20 0.40
ACE P12821 1/20 0.39
TBXAS1 P24557 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
SCHEMBL7360215 1.00 GPR132 (0.45) GPR132ITGB3ITGA2BCTSBCTSS
Sarcosine SCHEMBL7358194 0.88 ITGB3 (0.47) GPR132ITGB3ITGA2BCMKLR2CMKLR1
Sarcosine SCHEMBL7358185 0.88 ITGB3 (0.47) GPR132ITGB3ITGA2BCMKLR2CMKLR1
Hydrochloric Acid SCHEMBL7357051 0.80 SLC15A1 (0.46) GPR132LMNAKMT2ATDP1CYP3A4
Hydrochloric Acid SCHEMBL7357053 0.80 SLC15A1 (0.46) GPR132LMNAKMT2ATDP1CYP3A4
SCHEMBL7356951 0.78 CPB2 (0.41) GPR132CTSBCTSSCTSKCMKLR2
SCHEMBL10058309 0.75 SLC1A3 (0.50) ITGB3ITGA2BKMT2AALDH1A1
Arginine SCHEMBL7364644 0.74 ITGB3 (0.40) GPR132ITGB3ITGA2BITGAVTBXAS1
SCHEMBL6668234 0.73 ITGB3 (0.67) ITGB3ITGA2BITGAVADAMTS4ALDH1A1
SCHEMBL6093215 0.73 ITGB3 (0.67) ITGB3ITGA2BITGAVADAMTS4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6025472-A PEPTIDE ALDEHYDES WHICH ARE POTENT INHIBITORS OF FACTOR XA, USEFUL AS THERAPEUTIC AGENTS FOR DISEASE STATES IN MAMMALS CHARACTERIZED BY ABNORMAL THROMBOSIS CORVAS INTERNATIONAL, INC. (US) 2000-02-15 US disclosed
US-5696231-A ANTICOAGULANTS; CARDIOVASCULAR DISORDERS CORVAS INTERNATIONAL, INC. (US) 1997-12-09 US disclosed
EP-0801654-A1 N-SUBSTITUTED GLYCINE DERIVATIVES AS INHIBITORS OF FACTOR Xa CORVAS INTERNATIONAL, INC. (US) 1997-10-22 EP disclosed
WO-1996019493-A1 N-SUBSTITUTED GLYCINE DERIVATIVES AS INHIBITORS OF FACTOR Xa CORVAS INTERNATIONAL, INC. (US) 1996-06-27 WO disclosed