SCHEMBL31707012

SCHEMBL31707012

FC1(F)CCN(Cc2cc(Br)ccn2)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
HRH1 P35367 1/20 0.37
ADORA2A P29274 3/20 0.36
ADORA1 P30542 2/20 0.36
PDCD1 Q15116 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
KDM5C P41229 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
CXCR4 P61073 1/20 0.35
ANO1 Q5XXA6 1/20 0.34
SYK P43405 1/20 0.34
GRM2 Q14416 1/20 0.34
SIGMAR1 Q99720 3/20 0.33
CLK2 P49760 2/20 0.33
CLK3 P49761 2/20 0.33
DYRK1A Q13627 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 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
SCHEMBL27211100 0.88 KDM5C (0.35) CYP3A4HRH1KDM5CKDM4CCXCR4
SCHEMBL16132006 0.83 CCR1 (0.41) CYP3A4CYP2D6HRH1ADORA2AADORA1
SCHEMBL3398916 0.83 ADORA2A (0.41) CYP3A4CYP2D6HRH1ADORA2AADORA1
SCHEMBL13466925 0.82 CXCR4 (0.39) CYP3A4CYP2D6HRH1ADORA2AADORA1
SCHEMBL13467135 0.81 CYP3A4 (0.36) CYP3A4CYP2D6HRH1ADORA2AADORA1
SCHEMBL29204498 0.79 EGLN1 (0.44) CYP3A4CYP2D6HRH1ADORA2AADORA1
SCHEMBL30574738 0.78 SIGMAR1 (0.53) CYP3A4CYP2D6HRH1SIGMAR1OPRM1
SCHEMBL15274470 0.77 GRM2 (0.40) ADORA2AADORA1PDCD1CD274GRM2
SCHEMBL1722737 0.77 CXCR4 (0.50) CYP2D6KDM5CKDM4CCXCR4LMNA
SCHEMBL31706417 0.75 ADORA2A (0.34) CYP3A4CYP2D6HRH1ADORA2AADORA1

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-2025215558-A1 COMPOUNDS FOR SPLICING MODULATION FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2025-10-16 WO disclosed