SCHEMBL9250840

SCHEMBL9250840

O=C(O)Cc1[nH]c2ccccc2c1Cl

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.53
ALDH1A1 P00352 5/20 0.53
MAPT P10636 3/20 0.53
GAA P10253 1/20 0.53
CASP1 P29466 1/20 0.53
CASP7 P55210 1/20 0.53
EGFR P00533 3/20 0.51
LMNA P02545 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.43
HPGD P15428 2/20 0.42
HSD17B10 Q99714 1/20 0.42
SRC P12931 1/20 0.42
MET P08581 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL30479099 0.81 ALDH1A1 (0.54) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL114551 0.81 ALDH1A1 (0.54) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL11187489 0.79 ALDH1A1 (0.53) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL8064218 0.79 ALDH1A1 (0.53) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL5499463 0.79 ALDH1A1 (0.61) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL10685190 0.78 KDM4E (0.64) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL9756296 0.77 GPR17 (0.50) KDM4EALDH1A1MAPTGAAMEN1
SCHEMBL2648556 0.77 AHR (0.55) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL29477149 0.76 KDM4E (0.66) KDM4EALDH1A1MAPTGAACASP1
SCHEMBL28516422 0.76 KDM4E (0.66) KDM4EALDH1A1MAPTGAACASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7184496-A None JP disclosed
JP-H07184496-A CALLUS GROWTH MEDIUM NISSAN CHEM IND LTD 1995-07-25 JP disclosed