SCHEMBL10518331

SCHEMBL10518331

Nc1nc(-c2ccc(CNC(=O)COc3ccccc3)s2)cs1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ KDM4E B2RXH2 2/20 0.62
▸ MEN1 O00255 2/20 0.62
▸ ALDH1A1 P00352 2/20 0.62
▸ HSD17B10 Q99714 1/20 0.62
▸ HDAC1 Q13547 1/20 0.58
▸ HDAC8 Q9BY41 1/20 0.58
▸ LMNA P02545 1/20 0.50
▸ TSHR P16473 1/20 0.50
▸ HPGD P15428 3/20 0.49
▸ HTT P42858 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TRPM8 Q7Z2W7 1/20 0.44
▸ ERCC1 P07992 1/20 0.43
▸ ERCC4 Q92889 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.42
▸ TP53 P04637 1/20 0.41

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
Maleic Acid SCHEMBL10520798 0.95 MAPT (0.56) MAPTKMT2AKDM4EMEN1ALDH1A1
Fumaric Acid SCHEMBL10520811 0.95 MAPT (0.56) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10519264 0.89 KMT2A (0.57) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10520990 0.89 ALDH1A1 (0.60) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10519602 0.89 ALDH1A1 (0.63) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10519297 0.88 MEN1 (0.55) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10521322 0.85 MAPT (0.55) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10519183 0.85 MAPT (0.57) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10521269 0.85 ALDH1A1 (0.60) MAPTKMT2AKDM4EMEN1ALDH1A1
SCHEMBL10520132 0.85 ALDH1A1 (0.60) MAPTKMT2AKDM4EMEN1ALDH1A1

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