SCHEMBL8557670

SCHEMBL8557670

CCCc1[nH]c2cc(C(=O)OC)ccc2c1C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.53
MEN1 O00255 5/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
ALOX5 P09917 2/20 0.50
KIF11 P52732 1/20 0.50
PARP1 P09874 1/20 0.47
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 4/20 0.42
KDM4E B2RXH2 3/20 0.42
GAA P10253 3/20 0.42
MAPT P10636 2/20 0.42
HPGD P15428 2/20 0.42
GLA P06280 1/20 0.42
PKM P14618 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RAF1 P04049 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
SCHEMBL8553082 0.91 KIF11 (0.52) KMT2AMEN1ATML3MBTL1ALOX5
SCHEMBL8552714 0.86 KIF11 (0.49) KMT2AMEN1ATML3MBTL1ALOX5
SCHEMBL7418110 0.85 KMT2A (0.58) KMT2AMEN1ATML3MBTL1KIF11
SCHEMBL7416246 0.85 ALOX5 (0.44) KMT2AMEN1ATML3MBTL1ALOX5
SCHEMBL8554616 0.84 KIF11 (0.54) KMT2AMEN1KIF11PARP1ALDH1A1
SCHEMBL7423432 0.82 KMT2A (0.62) KMT2AMEN1ATML3MBTL1KIF11
SCHEMBL7419842 0.81 KMT2A (0.60) KMT2AMEN1ATML3MBTL1KIF11
SCHEMBL7409075 0.79 KMT2A (0.55) KMT2AMEN1ATML3MBTL1KIF11
SCHEMBL7419290 0.79 KMT2A (0.58) KMT2AMEN1ATML3MBTL1KIF11
SCHEMBL7422800 0.79 KMT2A (0.58) KMT2AMEN1ATML3MBTL1KIF11

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-0820441-A1 INDOLE DERIVATIVES AS cGMP-PDE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-28 EP disclosed