SCHEMBL7943525

SCHEMBL7943525

Cc1ccc2[nH]c(-c3ccc(C(=O)O)cc3)nc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.63
ALDH1A1 P00352 4/20 0.63
HPGD P15428 3/20 0.63
KMT2A Q03164 3/20 0.63
MMP2 P08253 2/20 0.59
MMP9 P14780 2/20 0.59
MMP8 P22894 2/20 0.59
MMP13 P45452 2/20 0.59
CHEK2 O96017 7/20 0.58
MEN1 O00255 2/20 0.56
GAA P10253 2/20 0.56
GLA P06280 1/20 0.56
NR4A2 P43354 1/20 0.56
MAPK1 P28482 1/20 0.53
MAP2K4 P45985 1/20 0.53
MAPKAPK3 Q16644 1/20 0.53
MAPK6 Q16659 1/20 0.53
HPSE Q9Y251 1/20 0.53
MPL P40238 1/20 0.52
CSNK1D P48730 1/20 0.52

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
SCHEMBL11564579 0.91 CHEK2 (0.61) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL7943528 0.89 MMP2 (0.71) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL11599478 0.88 KDM4E (0.70) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL7602620 0.88 KDM4E (0.70) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL3564386 0.88 CHEK2 (0.64) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL28930292 0.86 KDM4E (0.68) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL14494924 0.86 NPC1 (0.60) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL7036871 0.86 KDM4E (0.48) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL7444528 0.85 KDM4E (0.71) KDM4EALDH1A1HPGDKMT2AMMP2
SCHEMBL7574964 0.85 NPC1 (0.58) KDM4EALDH1A1HPGDKMT2AMMP2

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-6251689-B1 BINDING TO RESIN; OXIDATION TELIK, INC. 2001-06-26 US claimed