SCHEMBL9203435

SCHEMBL9203435

O=C(Nc1nnc(Cc2ccccc2)s1)c1c(O)c2ccccc2oc1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 4/20 0.59
▸ RAB9A P51151 3/20 0.59
▸ KMT2A Q03164 3/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.57
▸ TSHR P16473 1/20 0.54
▸ ABL1 P00519 2/20 0.54
▸ RXFP1 Q9HBX9 1/20 0.54
▸ CYP1A2 P05177 1/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ POLB P06746 2/20 0.52
▸ LMNA P02545 1/20 0.52
▸ ALDH1A1 P00352 2/20 0.51
▸ NPSR1 Q6W5P4 2/20 0.50
▸ NQO1 P15559 1/20 0.50
▸ THRB P10828 1/20 0.49
▸ APEX1 P27695 1/20 0.49
▸ APOBEC3A P31941 1/20 0.49

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
SCHEMBL9203177 0.92 POLB (0.55) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9201311 0.88 RXFP1 (0.59) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9200001 0.88 KMT2A (0.53) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9205774 0.86 RAB9A (0.53) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9201027 0.84 KDM4E (0.59) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL7640498 0.83 CA12 (0.51) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9202732 0.83 CA12 (0.51) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9208681 0.82 CA12 (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9203805 0.82 L3MBTL1 (0.54) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL9527322 0.81 MEN1 (0.42) NPC1RAB9AKMT2AMEN1SMN1; 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 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
Send feedback