SCHEMBL21728512

SCHEMBL21728512

CC(=O)c1ccc(C(O)Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.46
RAB9A P51151 4/20 0.46
HPGD P15428 3/20 0.46
LMNA P02545 3/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
POLB P06746 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
HSD17B1 P14061 1/20 0.45
MAPK1 P28482 2/20 0.42
NOS3 P29474 2/20 0.42
NOS1 P29475 2/20 0.42
NPC1 O15118 3/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
NLRP1 Q9C000 1/20 0.41
ALDH1A1 P00352 1/20 0.41
STAT3 P40763 1/20 0.41
STAT1 P42224 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
SCHEMBL11019038 0.84 MAPT (0.48) MAPTRAB9AHPGDLMNAKMT2A
SCHEMBL677963 0.82 MAPT (0.46) MAPTRAB9AHPGDLMNAKMT2A
SCHEMBL527583 0.81 MAPT (0.50) MAPTRAB9AHPGDLMNAKMT2A
SCHEMBL1262317 0.79 MAPT (0.48) MAPTRAB9AHPGDLMNAKMT2A
SCHEMBL12727277 0.79 ALDH1A1 (0.43) HPGDLMNAKMT2ASMN1; SMN2MEN1
SCHEMBL17319344 0.79 MAPT (0.48) MAPTRAB9AHPGDLMNAKMT2A
SCHEMBL16659380 0.78 MAPT (0.52) MAPTRAB9AHPGDLMNAKMT2A
SCHEMBL50646 0.77 MAPT (0.68) MAPTRAB9AHPGDLMNAKMT2A
SCHEMBL13240309 0.77 CA1 (0.55) MAPTRAB9AKMT2AL3MBTL1MEN1
SCHEMBL9683939 0.76 MAPT (0.50) MAPTRAB9AHPGDLMNAKMT2A

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-3094626-B1 SUBSTITUTED BICYCLIC HETEROARYL COMPOUNDS AS RXR AGONISTS CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2020-02-19 EP disclosed