SCHEMBL11782600

SCHEMBL11782600

CC=CCNc1cc(C(=O)O)cc(S(=O)(=O)Nc2ccc(NC(C)=O)cc2)c1Nc1ccc(NC(C)=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ GAA P10253 3/20 0.43
▸ GFER P55789 1/20 0.43
▸ PTGER4 P35408 1/20 0.42
▸ MAPT P10636 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ HTT P42858 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ EGFR P00533 1/20 0.38
▸ TSHR P16473 1/20 0.38

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
SCHEMBL11782595 1.00 MEN1 (0.43) MEN1KMT2AGAAGFERPTGER4
SCHEMBL11777604 0.89 CA2 (0.43) MEN1KMT2AGAAGFERMAPT
SCHEMBL11777610 0.89 CA2 (0.43) MEN1KMT2AGAAGFERMAPT
SCHEMBL11781708 0.84 MEN1 (0.48) MEN1KMT2AGAAGFERPTGER4
SCHEMBL11779282 0.80 CA2 (0.38) MEN1KMT2AGAAGFERMAPT
SCHEMBL11779276 0.80 CA2 (0.38) MEN1KMT2AGAAGFERMAPT
SCHEMBL11783471 0.79 MEN1 (0.53) MEN1KMT2AGAAGFERPTGER4
SCHEMBL11780536 0.78 BDKRB1 (0.41) MEN1KMT2AGAAGFERLMNA
SCHEMBL11777642 0.75 CA1 (0.48) MEN1KMT2AGAAGFERMAPT
SCHEMBL11802068 0.74 CA2 (0.56) MEN1KMT2AKDM4ELMNAALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3933906-A DIURETIC CIBA-GEIGY CORPORATION (US) 1976-01-20 — — US disclosed
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