SCHEMBL9830752

SCHEMBL9830752

CN1C(=O)C(c2ccccc2)Sc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.44
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA2 P00918 1/20 0.42
RAB9A P51151 2/20 0.42
GSK3B P49841 3/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL7300347 0.88 RAB9A (0.41) MAOAALDH1A1SMN1; SMN2CA2RAB9A
SCHEMBL10803547 0.84 MAOA (0.42) MAOAALDH1A1SMN1; SMN2CA2RAB9A
SCHEMBL9830266 0.79 RAB9A (0.67) ALDH1A1SMN1; SMN2RAB9AKMT2ANPC1
SCHEMBL4760288 0.79 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2CA2TSHRKMT2A
SCHEMBL10675503 0.77 MAOA (0.48) MAOAALDH1A1SMN1; SMN2RAB9AGSK3B
SCHEMBL10352937 0.77 MAOA (0.44) MAOAALDH1A1SMN1; SMN2RAB9AGSK3B
SCHEMBL7301681 0.76 CACNA1S (0.48) ALDH1A1SMN1; SMN2TSHRKMT2A
SCHEMBL27552536 0.76 KMT2A (0.45) ALDH1A1SMN1; SMN2CA2TSHRKMT2A
SCHEMBL7289212 0.76 MAOA (0.47) MAOAALDH1A1SMN1; SMN2RAB9AGSK3B
SCHEMBL11089059 0.75 MAOA (0.43) MAOAALDH1A1SMN1; SMN2RAB9AGSK3B

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-0233291-B1 2-ARYLBENZOTHIAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1991-03-13 EP claimed