SCHEMBL26103577

SCHEMBL26103577

Cc1ccncc1N1CCc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
ROCK1 Q13464 1/20 0.46
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 2/20 0.43
TP53 P04637 2/20 0.43
MAPK1 P28482 2/20 0.43
SRD5A1 P18405 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HPGD P15428 2/20 0.43
MKNK1 Q9BUB5 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
STAT3 P40763 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
ALOX15 P16050 3/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPT P10636 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL9193973 0.83 ROCK1 (0.50) SMN1; SMN2ROCK1ALDH1A1MEN1KMT2A
SCHEMBL798870 0.81 CYP11B2 (0.47) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL25026229 0.81 ALDH1A1 (0.55) SMN1; SMN2ROCK1ALDH1A1MEN1KMT2A
SCHEMBL9191760 0.79 ROCK1 (0.50) SMN1; SMN2ROCK1ALDH1A1MEN1KMT2A
SCHEMBL9767604 0.78 ALOX15 (0.51) SMN1; SMN2ROCK1ALDH1A1MEN1KMT2A
SCHEMBL9196015 0.76 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1MEN1KMT2ALMNA
SCHEMBL9194662 0.76 ALDH1A1 (0.50) SMN1; SMN2ROCK1ALDH1A1MEN1KMT2A
SCHEMBL18088239 0.75 CYP17A1 (0.48) ALDH1A1LMNAMAPK1MAPTCYP17A1
SCHEMBL807995 0.75 CYP11B2 (0.42) SRD5A1MAPT
SCHEMBL807907 0.75 CYP11B2 (0.43) MAPTHTR2CCYP17A1CYP1A2

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