SCHEMBL9549019

SCHEMBL9549019

Clc1cccc(C(c2ccccc2)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 7/20 0.50
TSHR P16473 4/20 0.46
CYP19A1 P11511 2/20 0.43
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
TP53 P04637 1/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL22154931 0.81 TAAR1 (0.52) KIF11TSHRNPC1RAB9ATP53
SCHEMBL29080708 0.79 KIF11 (0.49) KIF11TSHRCYP19A1ALDH1A1MAPK1
SCHEMBL11862867 0.79 KIF11 (0.49) KIF11TSHRCYP19A1ALDH1A1MAPK1
SCHEMBL30791489 0.79 KIF11 (0.49) KIF11TSHRCYP19A1ALDH1A1NPC1
SCHEMBL29048828 0.79 KIF11 (0.49) KIF11TSHRCYP19A1ALDH1A1MAPK1
SCHEMBL34403 0.79 KIF11 (0.49) KIF11TSHRCYP19A1ALDH1A1NPC1
SCHEMBL78619 0.78 HDAC4 (0.47) KIF11TSHRCYP19A1ALDH1A1NPSR1
SCHEMBL29441583 0.78 HDAC4 (0.47) KIF11TSHRCYP19A1ALDH1A1NPSR1
SCHEMBL30791490 0.77 CYP19A1 (0.62) KIF11TSHRCYP19A1MAPK1NPSR1
SCHEMBL2394054 0.77 CYP19A1 (0.62) KIF11TSHRCYP19A1MAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0290583-B1 $g(a) OLIGONUCLEOTIDES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1993-04-07 EP disclosed
EP-0290583-A1 -g(a) OLIGONUCLEOTIDES. CENTRE NAT RECH SCIENT (FR) 1988-11-17 EP disclosed
WO-1988004301-A1 alpha OLIGONUCLEOTIDES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS (FR) 1988-06-16 WO disclosed