SCHEMBL4062622

SCHEMBL4062622

O=c1cc(O)c2cc(F)ccc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ AR P10275 2/20 0.55
▸ FEN1 P39748 1/20 0.51
▸ KDR P35968 1/20 0.51
▸ DAO P14920 2/20 0.50
▸ GLA P06280 1/20 0.50
▸ GAA P10253 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ KEAP1 Q14145 1/20 0.50
▸ NFE2L2 Q16236 1/20 0.50
▸ KDM5A P29375 1/20 0.49
▸ BRD4 O60885 1/20 0.47
▸ DDO Q99489 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ HPGD P15428 1/20 0.45
▸ MPO P05164 1/20 0.45
▸ CDK5 Q00535 1/20 0.43
▸ CDK5R1 Q15078 1/20 0.43
▸ SMN1; SMN2 Q16637 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
SCHEMBL11468572 0.79 LMNA (0.62) KDM4EALDH1A1ARFEN1KDR
SCHEMBL1771631 0.78 KDM4E (0.59) KDM4EALDH1A1ARKDM5ABRD4
SCHEMBL16652203 0.78 KDM4E (0.59) KDM4EALDH1A1ARGLAGAA
SCHEMBL31081977 0.78 ALDH1A1 (0.59) KDM4EALDH1A1ARDAOGLA
SCHEMBL2054683 0.78 ALDH1A1 (0.59) KDM4EALDH1A1ARKDRKDM5A
SCHEMBL2272868 0.78 ALDH1A1 (0.59) KDM4EALDH1A1ARDAOGLA
SCHEMBL28834693 0.78 KDR (0.51) KDM4EALDH1A1ARFEN1KDR
SCHEMBL3223994 0.78 LMNA (0.66) KDM4EALDH1A1ARDAOGAA
SCHEMBL8363345 0.77 KDM4E (0.61) KDM4EALDH1A1FEN1KDRGLA
SCHEMBL26341078 0.76 MAP2 (0.50) KDM4EALDH1A1FEN1KDRGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009032177-A1 PHOSPHADIAZINE HCV POLYMERASE INHIBITORS I AND II IDENIX PHARMACEUTICALS, INC. (US) 2009-03-12 — — WO disclosed
CN-1535151-A Novel anti-infectives ʷ��˿�������ȳ�ķ���޹�˾ 2004-10-06 — — CN disclosed
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