SCHEMBL27582370

SCHEMBL27582370

CC(C)=CCC/C(C)=C/Cc1c(O)c2cc(C(=O)OCCO)ccc2oc1=O

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ VKORC1 Q9BQB6 2/20 0.59
▸ MGAM O43451 3/20 0.48
▸ GAA P10253 3/20 0.48
▸ SI P14410 3/20 0.48
▸ PTPN1 P18031 3/20 0.48
▸ MGAM2 Q2M2H8 3/20 0.48
▸ ALOX5 P09917 1/20 0.43
▸ TRPV1 Q8NER1 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
SCHEMBL27599715 0.83 VKORC1 (0.62) VKORC1MGAMGAASIPTPN1
SCHEMBL27599671 0.81 VKORC1 (0.59) VKORC1MGAMGAASIPTPN1
SCHEMBL27582309 0.80 VKORC1 (0.61) VKORC1MGAMGAASIPTPN1
SCHEMBL27599592 0.77 VKORC1 (0.62) VKORC1MGAMGAASIPTPN1
SCHEMBL16768172 0.76 VKORC1 (0.97) VKORC1MGAMGAASIPTPN1
SCHEMBL27599542 0.75 VKORC1 (0.56) VKORC1MGAMGAASIPTPN1
SCHEMBL5309688 0.74 VKORC1 (1.00) VKORC1MGAMGAASIPTPN1
SCHEMBL5309695 0.74 VKORC1 (1.00) VKORC1MGAMGAASIPTPN1
SCHEMBL27582360 0.74 VKORC1 (0.61) VKORC1MGAMGAASIPTPN1
SCHEMBL27599534 0.74 VKORC1 (0.58) VKORC1MGAMGAASIPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1473565-A Benzopyrany/derivatives and antiallergic agent ���ձ���ī��ѧ��ʽ���� 2004-02-11 — — CN disclosed
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