SCHEMBL30908183

SCHEMBL30908183

Cc1ccc2cc(C(F)F)c(Cl)nc2c1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.54
NPSR1 Q6W5P4 1/20 0.54
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 2/20 0.46
PABPC1 P11940 1/20 0.46
CYP1A2 P05177 2/20 0.44
GAA P10253 1/20 0.40
KDR P35968 8/20 0.39
RAB9A P51151 2/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL13394489 0.84 KMT2A (0.56) KMT2ANPSR1ALDH1A1KDM4EMAPT
SCHEMBL22237929 0.81 KMT2A (0.53) KMT2ANPSR1ALDH1A1KDM4EMAPT
SCHEMBL21682115 0.79 BACE1 (0.42) KMT2ANPSR1ALDH1A1PABPC1CYP1A2
SCHEMBL31123833 0.79 BACE1 (0.42) KMT2ANPSR1ALDH1A1PABPC1CYP1A2
SCHEMBL30908292 0.77 KMT2A (0.59) KMT2ANPSR1ALDH1A1KDM4EMAPT
SCHEMBL2178320 0.77 EGFR (0.53) KMT2AALDH1A1KDM4EMAPTGAA
SCHEMBL3835940 0.76 KMT2A (0.62) KMT2ANPSR1ALDH1A1KDM4EMAPT
SCHEMBL22509749 0.76 KMT2A (0.62) KMT2ANPSR1ALDH1A1KDM4EMAPT
SCHEMBL22509835 0.73 KMT2A (0.59) KMT2ANPSR1ALDH1A1KDM4EMAPT
SCHEMBL19243071 0.70 KMT2A (0.75) KMT2ANPSR1ALDH1A1KDM4EMAPT

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-2024074611-A1 PRMT5 INHIBITORS Ryvu Therapeutics S.A. (PL) 2024-04-11 WO disclosed