SCHEMBL5372335

SCHEMBL5372335

C=CCn1cc(C(=O)O)c(=O)c2cc(F)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.53
ALDH1A1 P00352 5/20 0.49
KDM4E B2RXH2 4/20 0.49
HPGD P15428 4/20 0.49
HSD17B10 Q99714 2/20 0.49
TSHR P16473 1/20 0.49
RAB9A P51151 1/20 0.49
LMNA P02545 4/20 0.46
HTT P42858 1/20 0.46
THRB P10828 1/20 0.45
USP2 O75604 1/20 0.44
MAPK1 P28482 1/20 0.44
MAPT P10636 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
APEX1 P27695 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
POLB P06746 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
SMN1; SMN2 Q16637 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
SCHEMBL3816590 0.84 PTPN1 (0.49) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9027382 0.84 KDM4E (0.68) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL30390219 0.84 KDM4E (0.68) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL26630665 0.82 KDM4C (0.58) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL11550104 0.82 KDM4E (0.52) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL9318038 0.81 KMT2A (0.52) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL11026652 0.81 KMT2A (0.58) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10330795 0.81 KMT2A (0.65) KMT2AALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1080329 0.81 LMNA (0.68) KDM4ELMNATP53
SCHEMBL28984977 0.80 KMT2A (0.43) KMT2AALDH1A1HPGDTHRBPOLB

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
JP-2007063180-A METHOD OF DETECTING NEW QUINOLONE ANTIBACTERIAL AGENT FRONTIER KENKYUSHO:KK 2007-03-15 JP disclosed