SCHEMBL10519940

SCHEMBL10519940

CN(C)Cc1cc(-c2csc(N)n2)cs1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.44
▸ LTA4H P09960 5/20 0.43
▸ RAB9A P51151 10/20 0.42
▸ NPC1 O15118 8/20 0.42
▸ MAPT P10636 7/20 0.42
▸ SMN1; SMN2 Q16637 6/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ NFKB1 P19838 2/20 0.42
▸ NFKB2 Q00653 2/20 0.42
▸ RELA Q04206 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ AR P10275 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ KMT2A Q03164 4/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MKNK1 Q9BUB5 1/20 0.42
▸ MKNK2 Q9HBH9 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ ALOX5 P09917 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
SCHEMBL10520856 0.81 ALDH1A1 (0.48) ALDH1A1LTA4HRAB9ANPC1MAPT
SCHEMBL11838315 0.77 LTA4H (0.62) ALDH1A1LTA4HRAB9ANPC1MAPT
SCHEMBL12495744 0.75 ATP4A (0.67) ALDH1A1LTA4HRAB9ANPC1MAPT
SCHEMBL10519089 0.75 ALDH1A1 (0.40) ALDH1A1LTA4HRAB9ANPC1MAPT
SCHEMBL10520826 0.73 ALDH1A1 (0.64) ALDH1A1LTA4HRAB9ANPC1MAPT
SCHEMBL21504858 0.73 ALDH1A1 (0.53) ALDH1A1LTA4HRAB9ANPC1MAPT
SCHEMBL10521340 0.71 SMN1; SMN2 (0.44) ALDH1A1LTA4HRAB9ANPC1MAPT
SCHEMBL5913878 0.71 HSD17B10 (0.48) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2
SCHEMBL16003854 0.69 ALDH1A1 (0.52) ALDH1A1LTA4HRAB9ANPC1MAPT
Hydrochloric Acid SCHEMBL308085 0.69 HSD17B10 (0.47) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2

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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