SCHEMBL25239348

SCHEMBL25239348

N#Cc1cc(Cl)cc2cc[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.46
F7 P08709 1/20 0.46
LTA4H P09960 1/20 0.46
F3 P13726 1/20 0.46
NR4A2 P43354 1/20 0.46
CHEK1 O14757 2/20 0.43
IMPDH2 P12268 1/20 0.42
IMPDH1 P20839 1/20 0.42
TNF P01375 1/20 0.39
RIPK1 Q13546 1/20 0.39
CMA1 P23946 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
GPR35 Q9HC97 2/20 0.36
MCL1 Q07820 1/20 0.36
IKBKB O14920 2/20 0.36
CHUK O15111 2/20 0.36
DYRK1A Q13627 1/20 0.35
AURKA O14965 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
SCHEMBL1420429 0.79 AHR (0.47) AHRCHEK1IMPDH2IMPDH1TNF
SCHEMBL31357932 0.79 AHR (0.47) AHRCHEK1IMPDH2IMPDH1TNF
SCHEMBL6793252 0.78 IMPDH2 (0.42) CHEK1IMPDH2IMPDH1RIPK1MCL1
SCHEMBL19611745 0.78 AHR (0.46) AHRNR4A2CHEK1IMPDH2IMPDH1
SCHEMBL18876088 0.78 IMPDH2 (0.42) CHEK1IMPDH2IMPDH1MAOAMAOB
SCHEMBL21315701 0.74 AHR (0.48) AHRF7LTA4HF3NR4A2
SCHEMBL838245 0.74 AHR (0.54) AHRF7LTA4HF3NR4A2
SCHEMBL18876051 0.74 IMPDH2 (0.39) CHEK1IMPDH2IMPDH1MCL1IKBKB
SCHEMBL18876116 0.74 IMPDH2 (0.39) CHEK1IMPDH2IMPDH1IKBKBCHUK
SCHEMBL18876113 0.74 MCL1 (0.43) CHEK1IMPDH2IMPDH1MCL1IKBKB

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-4182320-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Nido Biosciences, Inc. (US) 2023-05-24 EP disclosed
WO-2022020342-A1 INDOLE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. (US) 2022-01-27 WO disclosed