SCHEMBL9202008

SCHEMBL9202008

O=C(Nc1nnc(SCc2ccc(F)cc2)s1)c1c(O)c2ccccc2oc1=O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 8/20 0.59
▸ SRC P12931 8/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ KDM4E B2RXH2 3/20 0.59
▸ LMNA P02545 3/20 0.59
▸ HTT P42858 2/20 0.59
▸ HSP90AA1 P07900 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ OPRK1 P41145 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ PKM P14618 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ ABCC8 Q09428 1/20 0.51
▸ KCNJ11 Q14654 1/20 0.51
▸ ALDH1A1 P00352 1/20 0.50
▸ GAA P10253 1/20 0.50

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
SCHEMBL9201027 0.93 KDM4E (0.59) ABL1SRCSMN1; SMN2KDM4ELMNA
SCHEMBL9202116 0.90 KDM4E (0.51) ABL1SRCSMN1; SMN2KDM4ELMNA
SCHEMBL9207418 0.84 ALDH1A1 (0.49) SMN1; SMN2KDM4ELMNAHTTHSP90AA1
SCHEMBL9203437 0.82 ABL1 (0.60) ABL1SRCSMN1; SMN2KDM4ELMNA
SCHEMBL9203908 0.81 MAPT (0.62) SMN1; SMN2KDM4ELMNAHTTMAPT
SCHEMBL9205774 0.77 RAB9A (0.53) SMN1; SMN2KDM4ELMNAALDH1A1
SCHEMBL9202732 0.77 CA12 (0.51) SMN1; SMN2KDM4ELMNAHTTMAPT
SCHEMBL7640498 0.77 CA12 (0.51) SMN1; SMN2KDM4ELMNAHTTMAPT
SCHEMBL9203435 0.77 NPC1 (0.59) ABL1SMN1; SMN2LMNAMAPTTDP1
SCHEMBL9207001 0.77 NPC1 (0.56) SMN1; SMN2KDM4ELMNAHTTMAPT

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-0550493-B1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS UPJOHN CO (US) 1995-08-09 — — EP claimed
EP-0550493-A1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS. UPJOHN CO (US) 1993-07-14 — — EP claimed
WO-1992006083-A1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1992-04-16 — — WO claimed
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