SCHEMBL10521863

SCHEMBL10521863

CN(C)Cc1cccc(OCC(=O)NCc2csc(-c3csc(N)n3)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LSS P48449 1/20 0.50
▸ ROCK1 Q13464 6/20 0.44
▸ ROCK2 O75116 5/20 0.44
▸ NOS1 P29475 2/20 0.41
▸ NOS2 P35228 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ RAB9A P51151 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ PRKACA P17612 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ LTA4H P09960 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ ADORA2A P29274 1/20 0.38
▸ ADORA1 P30542 1/20 0.38

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
SCHEMBL10519858 0.91 TSHR (0.43) LSSROCK1ROCK2NOS1NOS2
SCHEMBL10518366 0.88 MAPT (0.53) LSSROCK1ROCK2NOS1NOS2
SCHEMBL10518226 0.85 KMT2A (0.54) HPGDKMT2ANPC1SMN1; SMN2GLA
SCHEMBL10520147 0.85 LSS (0.41) LSSROCK1ROCK2HPGDKMT2A
SCHEMBL10521093 0.85 LSS (0.47) LSSROCK1ROCK2NOS1NOS2
SCHEMBL10521013 0.82 HRH2 (0.48) ROCK1KMT2ASMN1; SMN2PRKACALMNA
SCHEMBL10868918 0.80 NOS1 (0.41) LSSROCK1ROCK2NOS1NOS2
SCHEMBL10521092 0.79 ALDH1A1 (0.37) LSSROCK1HPGDKMT2ARAB9A
SCHEMBL10621504 0.76 ALDH1A1 (0.46) HPGDKMT2ARAB9ANPC1MAPT
SCHEMBL10518550 0.76 TSHR (0.56) HPGDKMT2ACYP3A4LMNAMAPT

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-0183191-B1 THIENYLTHIAZOLE COMPOUNDS Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1989-05-10 — — EP disclosed
US-4720493-A Thienylthiazole compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1988-01-19 — — US disclosed
EP-0183191-A1 Thienylthiazole compounds Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-06-04 — — EP disclosed
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