SCHEMBL23536665

SCHEMBL23536665

Cc1ccc(C(=O)n2nc3cccnc3c2N2CCN(c3ncc(Cl)cc3F)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
GRM4 Q14833 1/20 0.40
PTGS2 P35354 1/20 0.39
SLC6A7 Q99884 1/20 0.39
USP2 O75604 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HCRTR1 O43613 1/20 0.37
CHRM4 P08173 2/20 0.37
ELANE P08246 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
LMNA P02545 1/20 0.36
MTOR P42345 1/20 0.35
RAB9A P51151 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.35
ENPP3 O14638 1/20 0.35
ALPL P05186 1/20 0.35
XIAP P98170 1/20 0.35

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
SCHEMBL21262632 0.65 SMN1; SMN2 (0.58) SMN1; SMN2MAPTKMT2A
SCHEMBL23536626 0.63 HSD11B1 (0.46) SMN1; SMN2ALDH1A1HTTMEN1KMT2A
SCHEMBL31381239 0.61 NEK2 (0.49) KDM4EUSP2HTTLMNA
SCHEMBL23570037 0.60 OPRK1 (0.41) KDM4EGRM4CHRM4ALDH1A1HTT
SCHEMBL15849381 0.60 KMT2A (0.42) GRM4SMN1; SMN2ALDH1A1HTTLMNA
SCHEMBL899662 0.60 CHRNB2 (0.50) CHRM4
SCHEMBL21262178 0.60 KDM4E (0.51) KDM4ESMN1; SMN2ALDH1A1RAB9A
SCHEMBL28790918 0.59 LMNA (0.42) KDM4EALDH1A1HTTLMNAMEN1
SCHEMBL12082726 0.59 KDM4E (1.00) KDM4ESLC6A7SMN1; SMN2ALDH1A1HTT
SCHEMBL25327609 0.58 SPR (0.44) GRM4USP2SMN1; SMN2ALDH1A1

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-2021127333-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed