SCHEMBL10519264

SCHEMBL10519264

Nc1cccc(OCC(=O)NCc2ccc(-c3csc(N)n3)s2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.57
▸ MAPT P10636 3/20 0.57
▸ ALDH1A1 P00352 3/20 0.57
▸ KDM4E B2RXH2 3/20 0.57
▸ MEN1 O00255 3/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ HDAC1 Q13547 1/20 0.47
▸ HDAC8 Q9BY41 1/20 0.47
▸ LMNA P02545 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ HPGD P15428 2/20 0.39
▸ TRPM8 Q7Z2W7 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ POLB P06746 2/20 0.37
▸ GAA P10253 2/20 0.37
▸ HTT P42858 3/20 0.37
▸ NCF1 P14598 1/20 0.37
▸ TP53 P04637 1/20 0.36

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
SCHEMBL10519297 0.90 MEN1 (0.55) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10518331 0.89 MAPT (0.62) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10521322 0.88 MAPT (0.55) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10519488 0.87 ALDH1A1 (0.52) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10518366 0.86 MAPT (0.53) KMT2AMAPTALDH1A1KDM4EMEN1
Maleic Acid SCHEMBL10520798 0.85 MAPT (0.56) KMT2AMAPTALDH1A1KDM4EMEN1
Fumaric Acid SCHEMBL10520811 0.85 MAPT (0.56) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10519602 0.83 ALDH1A1 (0.63) KMT2AMAPTALDH1A1KDM4EMEN1
SCHEMBL10520990 0.83 ALDH1A1 (0.60) KMT2AMAPTALDH1A1KDM4EMEN1
Oxalic Acid SCHEMBL10622034 0.81 ALDH1A1 (0.46) KMT2AMAPTALDH1A1KDM4EMEN1

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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