SCHEMBL8328735

SCHEMBL8328735

COC(=O)C(N)n1cnc2cc(C(=O)O)ccc21

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 6/20 0.65
HPGD P15428 4/20 0.48
FGFR1 P11362 4/20 0.48
TSHR P16473 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
HSD17B10 Q99714 1/20 0.45
GAA P10253 1/20 0.45
THRB P10828 1/20 0.43
HCAR2 Q8TDS4 1/20 0.42
RXRA P19793 1/20 0.41

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
SCHEMBL2352235 0.74 HCAR3 (0.65) HCAR3HPGDFGFR1TSHRNPSR1
SCHEMBL1306713 0.73 HCAR3 (0.60) HCAR3HPGDFGFR1TSHRNPSR1
SCHEMBL8464959 0.73 ITGB3 (0.44) TSHRALDH1A1HSD17B10
SCHEMBL599310 0.71 HCAR3 (0.65) HCAR3HPGDFGFR1TSHRNPSR1
SCHEMBL20819211 0.71 FGFR1 (0.56) HCAR3HPGDFGFR1TSHRNPSR1
Hydrochloric Acid SCHEMBL7330424 0.70 HCAR3 (0.63) HCAR3HPGDFGFR1TSHRNPSR1
Hydrochloric Acid SCHEMBL9631739 0.70 FGFR1 (0.59) HCAR3HPGDFGFR1TSHRNPSR1
SCHEMBL2297233 0.70 HCAR3 (0.55) HCAR3HPGDFGFR1TSHRNPSR1
SCHEMBL6441326 0.70 HCAR3 (0.76) HCAR3HPGDFGFR1NPSR1ALDH1A1
SCHEMBL30937457 0.69 HCAR3 (0.61) HCAR3HPGDFGFR1TSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0869787-A4 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORP (US) 1999-03-24 EP disclosed
EP-0869787-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1998-10-14 EP disclosed
WO-1997024119-A1 VITRONECTIN RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1997-07-10 WO disclosed