SCHEMBL14939641

SCHEMBL14939641

O=C1c2cccc(Cl)c2CC1(Br)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.34
NSD2 O96028 2/20 0.34
KDM4E B2RXH2 1/20 0.34
APAF1 O14727 1/20 0.34
TDP2 O95551 1/20 0.34
ABL1 P00519 1/20 0.34
GALK1 P51570 1/20 0.34
BLM P54132 1/20 0.34
RIN1 Q13671 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
BCHE P06276 2/20 0.33
DAO P14920 1/20 0.33
CES1 P23141 1/20 0.33
CFTR P13569 1/20 0.33
GOPC Q9HD26 1/20 0.33
GAA P10253 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL14938952 0.83 CDK5 (0.40) MAPTCFTRGOPCGAARAB9A
SCHEMBL14938950 0.81 SRD5A1 (0.36) MAPTCFTRGOPCGAARAB9A
SCHEMBL14939135 0.81 ALDH1A1 (0.40) MAPTKDM4EDAOCFTRGOPC
SCHEMBL14939637 0.78 ACHE (0.43) MAPTKDM4ERAB9AGSK3BKMT2A
SCHEMBL14938940 0.75 NPSR1 (0.49) MAPTTDP2CES1CFTRGOPC
SCHEMBL9495505 0.71 BLM (0.38) MAPTNSD2KDM4EAPAF1TDP2
SCHEMBL14939783 0.70 CASP6 (0.40) MAPTNPSR1KMT2A
SCHEMBL29237769 0.69 NSD2 (0.36) MAPTNSD2KDM4EAPAF1TDP2
SCHEMBL14939719 0.69 KDM1A (0.36) CES1GSK3B
SCHEMBL14939587 0.68 NSD2 (0.39) MAPTNSD2KDM4EAPAF1TDP2

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
WO-2013068785-A1 INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS ACTELION PHARMACEUTICALS LTD (CH) 2013-05-16 WO disclosed