SCHEMBL24523923

SCHEMBL24523923

N#Cc1cc2c(c3cccc4c5c6c(sc7ccccc76)c(C#N)cc5n2c34)c2c1sc1ccccc12

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
SLC9A1 P19634 1/20 0.32
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
IMPDH2 P12268 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
PARP14 Q460N5 1/20 0.31
GPR3 P46089 1/20 0.31
RXFP1 Q9HBX9 2/20 0.30
ALDH1A1 P00352 1/20 0.30
PTPN1 P18031 1/20 0.30
ALOX5 P09917 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL24524263 0.89 RAB9A (0.34) RAB9AEGLN1SLC9A1TNKSTNKS2
SCHEMBL24523766 0.74 BRDT (0.36) RAB9ASLC9A1SLC22A12GPR3
SCHEMBL24524252 0.73 IMPDH2 (0.37) IMPDH2ALDH1A1MAPT
SCHEMBL17540374 0.73 TNKS (0.36) RAB9AEGLN1SLC9A1TNKSTNKS2
SCHEMBL24523770 0.72 IMPDH2 (0.38) IMPDH2SLC22A12ALDH1A1MAPT
SCHEMBL24524255 0.72 KDM4E (0.40) IMPDH2ALDH1A1
SCHEMBL19978063 0.71 GPR3 (0.40) RAB9AEGLN1TNKSTNKS2GPR3
SCHEMBL22450497 0.71 IMPDH2 (0.33) RAB9AEGLN1TNKSTNKS2IMPDH2
SCHEMBL24523731 0.71 IMPDH2 (0.33) IMPDH2ALDH1A1MAPT
SCHEMBL24523750 0.70 MAOA (0.40) IMPDH2RXFP1ALDH1A1MAPT

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