SCHEMBL10518226

SCHEMBL10518226

Nc1nc(-c2cc(CNC(=O)COc3ccccc3)cs2)cs1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.54
▸ HPGD P15428 2/20 0.54
▸ ERCC1 P07992 1/20 0.50
▸ ERCC4 Q92889 1/20 0.50
▸ MAPT P10636 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ TSHR P16473 1/20 0.49
▸ HTT P42858 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ MEN1 O00255 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ GAA P10253 1/20 0.45
▸ HDAC1 Q13547 1/20 0.45
▸ HDAC8 Q9BY41 1/20 0.45
▸ NPC1 O15118 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ TP53 P04637 1/20 0.43

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
SCHEMBL10518550 0.89 TSHR (0.56) KMT2AHPGDMAPTLMNATSHR
SCHEMBL10521863 0.85 LSS (0.50) KMT2AHPGDMAPTLMNATSHR
SCHEMBL10518331 0.83 MAPT (0.62) KMT2AHPGDERCC1ERCC4MAPT
SCHEMBL10521013 0.82 HRH2 (0.48) KMT2AMAPTLMNASMN1; SMN2MEN1
SCHEMBL10621504 0.81 ALDH1A1 (0.46) KMT2AHPGDMAPTHTTMEN1
SCHEMBL10520818 0.80 HPGD (0.48) KMT2AHPGDERCC1ERCC4MAPT
Maleic Acid SCHEMBL10520798 0.79 MAPT (0.56) KMT2AHPGDERCC1ERCC4MAPT
Fumaric Acid SCHEMBL10520811 0.79 MAPT (0.56) KMT2AHPGDERCC1ERCC4MAPT
SCHEMBL10520147 0.78 LSS (0.41) KMT2AHPGDMAPTLMNATSHR
SCHEMBL10520814 0.76 MAPT (0.64) KMT2AMAPTSMN1; SMN2MEN1ALDH1A1

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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