SCHEMBL31448722

SCHEMBL31448722

CN(Cc1nnnn1-c1ccc(Cl)cn1)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 2/20 0.37
▸ HRH4 Q9H3N8 1/20 0.37
▸ ALDH1A1 P00352 5/20 0.37
▸ RAB9A P51151 1/20 0.36
▸ CHEK1 O14757 1/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ FYN P06241 1/20 0.35
▸ RET P07949 1/20 0.35
▸ MET P08581 1/20 0.35
▸ PDGFRB P09619 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ FGFR1 P11362 1/20 0.35
▸ PDGFRA P16234 1/20 0.35
▸ LTK P29376 1/20 0.35
▸ MAP2K2 P36507 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ MAPK8 P45983 1/20 0.35
▸ MAPK9 P45984 1/20 0.35
▸ CDK8 P49336 1/20 0.35
▸ GSK3B P49841 1/20 0.35

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
SCHEMBL31448677 0.87 ALDH1A1 (0.37) ALDH1A1RAB9ALMNAPOLBGAA
SCHEMBL31448696 0.86 ALDH1A1 (0.35) ALDH1A1RAB9ALMNAPOLBGAA
SCHEMBL31448734 0.85 ALDH1A1 (0.35) ALDH1A1LMNAPOLBGAAMAPT
SCHEMBL31448703 0.84 ALDH1A1 (0.34) ALDH1A1LMNAGAAMAPTSMN1; SMN2
SCHEMBL30774766 0.83 ALDH1A1 (0.53) HRH3HRH4ALDH1A1RAB9ALMNA
SCHEMBL31448717 0.83 ALDH1A1 (0.33) ALDH1A1GAATRPV1MAPTTSHR
SCHEMBL30774675 0.78 HRH3 (0.34) HRH3HRH4ALDH1A1CHEK1NTRK1
SCHEMBL30774808 0.77 LMNA (0.44) ALDH1A1CHEK1NTRK1FYNRET
SCHEMBL31448694 0.77 MAPT (0.37) ALDH1A1RAB9ALMNAGAAMAPT
SCHEMBL31448733 0.77 HSD11B1 (0.34) ALDH1A1LMNAGAATRPV1MAPT

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-119654312-A Substituted tetrazolyl compounds useful as T cell activators 百时美施贵宝公司 2025-03-18 — — CN claimed
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