SCHEMBL10607948

SCHEMBL10607948

CN(C)N1C(=O)C(c2ccccc2)(c2ccccc2)CSC1=S

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.38
▸ GSK3A P49840 3/20 0.33
▸ GSK3B P49841 3/20 0.33
▸ CNR1 P21554 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ OPRM1 P35372 3/20 0.33
▸ OPRL1 P41146 3/20 0.33
▸ OPRK1 P41145 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ SLC6A2 P23975 1/20 0.30
▸ SLC6A4 P31645 1/20 0.30
▸ SLC6A3 Q01959 1/20 0.30

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
SCHEMBL10604466 0.85 CNR1 (0.35) ALDH1A1CNR1SMN1; SMN2OPRM1OPRL1
SCHEMBL10575710 0.81 ALDH1A1 (0.41) ALDH1A1GSK3AGSK3BCNR1SMN1; SMN2
SCHEMBL10607870 0.72 ALDH1A1 (0.42) ALDH1A1CNR1SMN1; SMN2
SCHEMBL10576643 0.70 BACE1 (0.39) ALDH1A1CNR1SMN1; SMN2
SCHEMBL10604918 0.69 OPRM1 (0.35) ALDH1A1CNR1OPRM1OPRL1MEN1
SCHEMBL10576467 0.67 BACE1 (0.43) GSK3AGSK3BCNR1MEN1KMT2A
SCHEMBL10576456 0.63 GSK3A (0.54) ALDH1A1GSK3AGSK3BCNR1MEN1
SCHEMBL6537130 0.63 ALDH1A1 (0.42) ALDH1A1CNR1SMN1; SMN2OPRM1OPRL1
SCHEMBL10570645 0.61 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10575245 0.60 ATM (0.40) ALDH1A1CNR1SMN1; SMN2MEN1MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0119516-B1 3-AMINO-TETRAHYDRO-1,3-THIAZINE-2,4-DIONES, THEIR USE AND AGENTS CONTAINING THESE COMPOUNDS FOR THE TREATMENT OF THE SKIN Wella Aktiengesellschaft (DE) 1989-09-20 — — EP disclosed
US-4654339-A PROTECT THE SKIN AGAINST THE SUN, COLD AND AGING WELLA AKTIENGESELLSCHAFT (DE) 1987-03-31 — — US disclosed
WO-1984003699-A1 3-AMINO-TETRAHYDRO-1,3-THIAZINE-2,4-DIONE, UTILISATION THEREOF AND SKIN TREATMENT PRODUCT CONTAINING SAID COMPOUNDS WELLA AG (DE) 1984-09-27 — — WO disclosed
EP-0119516-A1 3-Amino-tetrahydro-1,3-thiazine-2,4-diones, their use and agents containing these compounds for the treatment of the skin Wella Aktiengesellschaft (DE) 1984-09-26 — — EP disclosed
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