SCHEMBL10521269

SCHEMBL10521269

Nc1nc(-c2ccc(CNC(=O)COCc3ccccc3)s2)cs1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.60
▸ KDM4E B2RXH2 1/20 0.60
▸ MEN1 O00255 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ HSD17B10 Q99714 1/20 0.60
▸ CSNK1D P48730 2/20 0.46
▸ HDAC8 Q9BY41 3/20 0.44
▸ HDAC1 Q13547 2/20 0.42
▸ TRPV1 Q8NER1 2/20 0.39
▸ HRH2 P25021 1/20 0.39
▸ HRH4 Q9H3N8 1/20 0.39
▸ ADORA3 P0DMS8 1/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ ADORA1 P30542 1/20 0.39
▸ LTA4H P09960 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ HDAC3 O15379 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC7 Q8WUI4 1/20 0.37

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
SCHEMBL10518331 0.85 MAPT (0.62) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10518084 0.84 ALDH1A1 (0.68) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10520132 0.83 ALDH1A1 (0.60) ALDH1A1KDM4EMEN1MAPTKMT2A
Fumaric Acid SCHEMBL10520811 0.81 MAPT (0.56) ALDH1A1KDM4EMEN1MAPTKMT2A
Maleic Acid SCHEMBL10520798 0.81 MAPT (0.56) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10520584 0.80 ALDH1A1 (0.72) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10519183 0.79 MAPT (0.57) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10519701 0.79 ALDH1A1 (0.74) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10519497 0.78 ALDH1A1 (0.62) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL10519765 0.78 ALDH1A1 (0.65) ALDH1A1KDM4EMEN1MAPTKMT2A

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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