SCHEMBL31533451

SCHEMBL31533451

Cc1nsc(-c2ccccc2O)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 3/20 0.47
SMN1; SMN2 Q16637 4/20 0.45
ALDH1A1 P00352 2/20 0.45
HSD17B10 Q99714 3/20 0.42
KMT2A Q03164 3/20 0.40
RAB9A P51151 2/20 0.40
CASP3 P42574 2/20 0.40
SENP8 Q96LD8 2/20 0.40
SENP7 Q9BQF6 2/20 0.40
SENP6 Q9GZR1 2/20 0.40
MAPK1 P28482 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.38
HPGD P15428 3/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 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
SCHEMBL14420398 0.81 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1KMT2ARAB9ACASP3
SCHEMBL13889827 0.79 SMN1; SMN2 (0.48) HTR2BSMN1; SMN2ALDH1A1HSD17B10KMT2A
SCHEMBL7400239 0.79 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1HSD17B10KMT2ARAB9A
SCHEMBL7397370 0.73 KDM4E (0.49) SMN1; SMN2ALDH1A1KMT2ARAB9AHPGD
SCHEMBL6849437 0.72 ADORA3 (0.59) SMN1; SMN2ALDH1A1HSD17B10RAB9AMAPK1
SCHEMBL2048608 0.72 HTR2B (0.57) HTR2BSMN1; SMN2ALDH1A1HSD17B10KMT2A
SCHEMBL24919879 0.70 HTR2B (0.64) HTR2BTRPM8
SCHEMBL15423021 0.70 HTR2B (0.64) HTR2BSMN1; SMN2ALDH1A1HSD17B10KMT2A
SCHEMBL14112069 0.68 ALDH1A1 (0.76) SMN1; SMN2ALDH1A1HSD17B10KMT2ACASP3
SCHEMBL9313715 0.68 HTR2B (0.53) HTR2BSMN1; SMN2ALDH1A1HSD17B10KMT2A

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
CN-119968377-A Phosphoramidate compounds and uses thereof 安锐生物医药公司 2025-05-09 CN disclosed