SCHEMBL6603894

SCHEMBL6603894

O=C(O)c1csc(-c2ccc(C(F)(F)F)cc2Cl)n1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.73
EIF4E P06730 4/20 0.56
GAA P10253 1/20 0.48
NR1H4 Q96RI1 1/20 0.47
MRGPRX4 Q96LA9 2/20 0.46
MAPK1 P28482 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
ACHE P22303 1/20 0.46
ALDH1A1 P00352 1/20 0.45
IDE P14735 1/20 0.45
MAPK10 P53779 1/20 0.45
TLR7 Q9NYK1 2/20 0.44
PRKD3 O94806 1/20 0.44
PRKCG P05129 1/20 0.44
PRKCB P05771 1/20 0.44
IL1R1 P14778 1/20 0.44
PRKCA P17252 1/20 0.44
TNFRSF1A P19438 1/20 0.44
PRKCH P24723 1/20 0.44

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
SCHEMBL30775593 0.81 PRKD3 (0.62) NPSR1EIF4EACHEALDH1A1TLR7
SCHEMBL22637490 0.81 PRKD3 (0.62) NPSR1EIF4EACHEALDH1A1TLR7
SCHEMBL26319829 0.80 PRKD3 (0.51) NPSR1EIF4EACHEALDH1A1TLR7
SCHEMBL3533598 0.79 ALDH1A1 (0.65) NR1H4MAPK1LMNAMAPTALDH1A1
SCHEMBL2638150 0.77 ALDH1A1 (0.73) EIF4ENR1H4MAPK1ALDH1A1IDE
SCHEMBL2879349 0.76 ALDH1A1 (0.56) EIF4ENR1H4MAPK1LMNAMAPT
SCHEMBL2691637 0.75 ACHE (0.61) EIF4EACHEALDH1A1TLR7PRKD3
SCHEMBL12409127 0.74 PTGER1 (0.72) CYP1A2CYP2C9CYP2C19PTGER1
SCHEMBL31703651 0.74 NPSR1 (0.64) NPSR1EIF4EGAANR1H4MAPK1
SCHEMBL15608763 0.73 KMO (0.55) EIF4EACHEALDH1A1TLR7PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1237849-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2002-09-11 EP claimed
WO-2001032604-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2001-05-10 WO claimed
EP-1102535-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2004-09-29 EP disclosed
EP-1237849-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2002-09-11 EP disclosed
US-6399656-B1 USING A BENZOPYRAN-3-CARBOXAMIDE COMPOUND SMITHKLINE BEECHAM CORPORATION 2002-06-04 US disclosed
EP-1102535-A2 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2001-05-30 EP disclosed
WO-2001032604-A1 ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE UNIVERSITY COLLEGE LONDON (GB) 2001-05-10 WO disclosed
WO-2000006085-A2 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-10 WO disclosed