SCHEMBL26464741

SCHEMBL26464741

CNCc1cc(-c2cnccc2C)ccc1N

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 7/20 0.49
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
CYP11B1 P15538 7/20 0.46
CYP11B2 P19099 7/20 0.46
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
MAP4K1 Q92918 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
GRIA2 P42262 1/20 0.38
KLKB1 P03952 1/20 0.38
PTGES2 Q9H7Z7 1/20 0.37

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
SCHEMBL30494267 0.84 PRMT5 (0.53) ABL1PRMT5WDR77CYP11B1CYP11B2
SCHEMBL30494281 0.79 ABL1 (0.59) ABL1PRMT5WDR77CYP11B1CYP11B2
SCHEMBL26464927 0.79 ABL1 (0.59) ABL1PRMT5WDR77CYP11B1CYP11B2
SCHEMBL10273624 0.75 ABL1 (0.55) ABL1PRMT5WDR77CYP11B1CYP11B2
SCHEMBL26463262 0.75 ABL1 (0.55) ABL1PRMT5WDR77CYP11B1CYP11B2
SCHEMBL30494340 0.75 ABL1 (0.55) ABL1PRMT5WDR77CYP11B1CYP11B2
SCHEMBL26464740 0.74 CYP11B1 (0.58) ABL1PRMT5WDR77CYP11B1CYP11B2
SCHEMBL13456619 0.73 SLC6A2 (0.44) SLC6A2SLC6A4CYP2D6CYP2C9CYP2C19
SCHEMBL25455050 0.73 MAP4K4 (0.49) PRMT5WDR77SLC6A2SLC6A4CYP2D6
SCHEMBL11267771 0.72 ABL1 (0.58) ABL1PRMT5WDR77CYP11B1CYP11B2

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-2023072026-A1 SARM1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2023-05-04 WO disclosed