SCHEMBL6977467

SCHEMBL6977467

CSc1ccc(-c2cc(=O)c3ccc(F)cc3o2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.72
KDM4E B2RXH2 3/20 0.68
ALDH1A1 P00352 3/20 0.68
HPGD P15428 3/20 0.68
SMN1; SMN2 Q16637 2/20 0.68
MAPT P10636 2/20 0.68
GLA P06280 1/20 0.68
GAA P10253 1/20 0.68
RAB9A P51151 1/20 0.68
GABRP O00591 4/20 0.58
GABRD O14764 4/20 0.58
GABRA1 P14867 4/20 0.58
GABRB1 P18505 4/20 0.58
GABRG2 P18507 4/20 0.58
GABRB3 P28472 4/20 0.58
GABRA5 P31644 4/20 0.58
GABRA3 P34903 4/20 0.58
GABRA2 P47869 4/20 0.58
GABRB2 P47870 4/20 0.58
GABRA4 P48169 4/20 0.58

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
SCHEMBL6981850 0.89 GABRP (0.76) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL15231231 0.81 MAOB (0.77) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL6974228 0.81 RAB9A (1.00) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
7-Fluoroflavone SCHEMBL12961037 0.81 MAOB (1.00) MAOBKDM4EHPGDSMN1; SMN2MAPT
SCHEMBL30674786 0.76 MAOB (1.00) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL9142214 0.76 MAOB (1.00) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL23804650 0.75 MAOB (0.82) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL22083761 0.75 QPCT (0.67) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL29114175 0.74 MAOB (0.62) MAOBKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL30626961 0.74 MAOB (0.62) MAOBKDM4EALDH1A1HPGDSMN1; SMN2

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
EP-1105384-B1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORP (KR) 2003-03-26 EP disclosed
US-6340694-B1 Diarylbenzopyran derivatives as cyclooxygenase-2 inhibitors PACIFIC CORPORATION (KR) 2002-01-22 US disclosed
EP-1105384-A1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2001-06-13 EP disclosed
WO-2000010993-A1 DIARYLBENZOPYRAN DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2000-03-02 WO disclosed