SCHEMBL14880239

SCHEMBL14880239

Clc1ccc(C2=NOC(c3ccccc3)C2)cc1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.52
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
KMT2A Q03164 1/20 0.46
PTPN1 P18031 1/20 0.46
ATM Q13315 1/20 0.46
TSHR P16473 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
S1PR1 P21453 1/20 0.44
FAAH O00519 2/20 0.44

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
SCHEMBL30866950 0.94 MAOB (0.52) MAOBCA1CA2PPARGPPARA
SCHEMBL6939090 0.88 TSHR (0.51) MAOBCA1CA2PPARGPPARA
SCHEMBL14880611 0.84 MIF (0.52) MAOBPPARGPPARAPTPN1ATM
SCHEMBL12922866 0.82 PTPN1 (0.47) MAOBCA1CA2PPARGPPARA
SCHEMBL28943009 0.80 RARA (0.51) MAOBCA1CA2PPARGPPARA
SCHEMBL30866951 0.80 S1PR1 (0.54) MAOBPPARGPPARAPTPN1ATM
SCHEMBL12419631 0.80 TSHR (0.46) MAOBCA1CA2PPARGPPARA
SCHEMBL3969669 0.79 ATM (0.47) MAOBCA1CA2PPARGPPARA
SCHEMBL31374921 0.78 PPARG (0.46) MAOBCA1CA2PPARGPPARA
SCHEMBL3968910 0.77 ATM (0.46) MAOBCA1CA2PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2768814-A1 NOVEL NON-STEROIDAL COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS FLX Discoveries OY (FI) 2014-08-27 EP disclosed
WO-2013057372-A1 NOVEL NON-STEROIDAL COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS PULKKINEN JUHA (FI) 2013-04-25 WO disclosed