SCHEMBL24523729

SCHEMBL24523729

N#Cc1cc2c(c(C(F)(F)F)c1C(F)(F)F)c1cccc3c4c(C(F)(F)F)c(C(F)(F)F)c(C#N)cc4n2c13

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 16/20 0.34
PGR P06401 7/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
ELANE P08246 1/20 0.31
IMPDH2 P12268 1/20 0.31

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
SCHEMBL24523752 0.77 KDM4E (0.34) KDM4EALDH1A1GAAMAPTIMPDH2
SCHEMBL24523731 0.77 IMPDH2 (0.33) KDM4EALDH1A1GAAMAPTIMPDH2
SCHEMBL24523770 0.75 IMPDH2 (0.38) KDM4EALDH1A1GAAMAPTIMPDH2
SCHEMBL24523744 0.75 AR (0.44) ARPGR
SCHEMBL24523964 0.72 PNMT (0.31) KDM4EALDH1A1ELANEIMPDH2
SCHEMBL24524314 0.72 PNMT (0.33) ARKDM4EALDH1A1GAAMAPT
SCHEMBL24524356 0.71 KDM4E (0.33) KDM4EALDH1A1IMPDH2
SCHEMBL24523742 0.71 IMPDH2 (0.34) KDM4EALDH1A1GAAMAPTIMPDH2
SCHEMBL24523750 0.71 MAOA (0.40) KDM4EALDH1A1GAAMAPTIMPDH2
SCHEMBL24523738 0.69 TRPV4 (0.38) KDM4EALDH1A1MAPTIMPDH2

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-2022129116-A1 INDOLO[3.2.1-JK]CARBAZOLE-6-CARBONITRILE DERIVATIVES AS BLUE FLUORESCENT EMITTERS FOR USE IN OLEDS MERCK PATENT GMBH (DE) 2022-06-23 WO disclosed