SCHEMBL9203908

SCHEMBL9203908

CSc1nnc(NC(=O)c2c(O)c3ccccc3oc2=O)s1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.62
▸ NPC1 O15118 6/20 0.51
▸ CA12 O43570 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ THRB P10828 1/20 0.50
▸ RAB9A P51151 6/20 0.49
▸ POLB P06746 2/20 0.49
▸ ALDH1A1 P00352 5/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.44
▸ G6PD P11413 1/20 0.44
▸ HTT P42858 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ HPGD P15428 1/20 0.43
▸ VKORC1 Q9BQB6 1/20 0.42

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 0.85 KDM4E (0.59) MAPTNPC1THRBRAB9AALDH1A1
SCHEMBL7640498 0.84 CA12 (0.51) MAPTNPC1CA12CA9RAB9A
SCHEMBL9202732 0.84 CA12 (0.51) MAPTNPC1CA12CA9RAB9A
SCHEMBL9208681 0.83 CA12 (0.50) MAPTNPC1CA12CA9RAB9A
SCHEMBL9205672 0.83 RAB9A (0.53) MAPTNPC1CA12CA9RAB9A
SCHEMBL9202116 0.82 KDM4E (0.51) MAPTNPC1THRBRAB9AALDH1A1
SCHEMBL9205774 0.82 RAB9A (0.53) NPC1CA12CA9RAB9APOLB
SCHEMBL9207418 0.81 ALDH1A1 (0.49) MAPTNPC1THRBRAB9APOLB
SCHEMBL9202008 0.81 ABL1 (0.59) MAPTALDH1A1SMN1; SMN2KDM4EHTT
SCHEMBL9208153 0.80 NPC1 (0.64) MAPTNPC1CA12CA9RAB9A

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
EP-0550493-B1 ANTHELMINTIC AND ANTICOCCIDAL 3-CARBAMOYL-4-HYDROXYCOUMARINS, METHOD OF USE AND COMPOSITIONS UPJOHN CO (US) 1995-08-09 — — EP claimed
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