SCHEMBL6959628

SCHEMBL6959628

COC(=O)C(C([O])=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.62
MMP8 P22894 1/20 0.53
ALDH1A1 P00352 4/20 0.50
SRC P12931 1/20 0.50
MEN1 O00255 3/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
LMNA P02545 1/20 0.46
GLS O94925 2/20 0.46
TSHR P16473 2/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL3598733 0.90 KMT2A (0.69) KMT2AMMP8ALDH1A1SRCMEN1
Ammonia Solution, Strong SCHEMBL27830689 0.88 KMT2A (0.67) KMT2AMMP8ALDH1A1SRCMEN1
SCHEMBL2914808 0.86 KMT2A (0.64) KMT2AMMP8ALDH1A1SRCMEN1
SCHEMBL6959479 0.85 MMP8 (0.68) KMT2AMMP8SRCMEN1TSHR
SCHEMBL11031397 0.84 KMT2A (0.62) KMT2AMMP8ALDH1A1SRCMEN1
SCHEMBL2227571 0.84 KMT2A (0.62) KMT2AMMP8ALDH1A1SRCMEN1
SCHEMBL11679477 0.82 KMT2A (0.60) KMT2AMMP8ALDH1A1SRCMEN1
SCHEMBL13158250 0.81 KMT2A (0.58) KMT2AMMP8ALDH1A1SRCMEN1
SCHEMBL28474562 0.81 MMP8 (0.73) KMT2AMMP8ALDH1A1MEN1GLS
SCHEMBL17295202 0.79 KMT2A (0.56) KMT2AMMP8ALDH1A1SRCMEN1

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
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed