SCHEMBL7300347

SCHEMBL7300347

CN1C(=O)C(c2ccc(O)cc2)Sc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.41
MAOA P21397 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MYLK Q15746 2/20 0.38
NPC1 O15118 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
ESR1 P03372 2/20 0.36
CAPN1 P07384 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ESR2 Q92731 1/20 0.35
GSK3B P49841 1/20 0.35
LMNA P02545 1/20 0.35
CACNA1S Q13698 1/20 0.35
CA2 P00918 1/20 0.35

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
SCHEMBL9830752 0.88 MAOA (0.44) RAB9AMAOAALDH1A1SMN1; SMN2NPC1
SCHEMBL10672173 0.81 OPRK1 (0.37) MAOASMN1; SMN2CYP1A2CYP2C19CAPN1
SCHEMBL7280040 0.78 CYP2D6 (0.52) RAB9AALDH1A1SMN1; SMN2NPC1TP53
SCHEMBL10858951 0.77 ACE (0.43) SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL9830266 0.77 RAB9A (0.67) RAB9AALDH1A1SMN1; SMN2NPC1TP53
SCHEMBL7291421 0.76 CYP2C19 (0.41) ALDH1A1SMN1; SMN2CYP2C19MEN1KMT2A
SCHEMBL7301681 0.74 CACNA1S (0.48) ALDH1A1SMN1; SMN2ESR1KDM4EMEN1
SCHEMBL10803547 0.73 MAOA (0.42) RAB9AMAOAALDH1A1SMN1; SMN2GSK3B
SCHEMBL10675503 0.73 MAOA (0.48) RAB9AMAOAALDH1A1SMN1; SMN2NPC1
SCHEMBL10352937 0.72 MAOA (0.44) RAB9AMAOAALDH1A1SMN1; SMN2NPC1

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 5 patents. 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 disclosed
US-4739050-A CALCIUM ANTAGONIST, ANTICOAGULANT SANTEN PHARMACEUTICAL CO., LTD. (JP) 1988-04-19 US disclosed
EP-0233291-A1 2-ARYLBENZOTHIAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1987-08-26 EP disclosed
US-4584300-A Platelet anti-aggregative- and calcium antagonistic -1,4-benzothiazin-3-one derivatives, compositions, and methods of use therefor SANTEN PHARMACEUTICAL CO., LTD. (JP) 1986-04-22 US disclosed
EP-0116368-A1 Benzothiazine derivatives SANTEN PHARMACEUTICAL CO., LTD. (JP) 1984-08-22 EP disclosed