SCHEMBL9753537

SCHEMBL9753537

c1cc2nc(-c3nnn[nH]3)cn2cc1CCc1nnn[nH]1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.38
ALDH1A1 P00352 3/20 0.31
RAB9A P51151 3/20 0.31
NPC1 O15118 2/20 0.31
KDM4E B2RXH2 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 1/20 0.31
MITF O75030 1/20 0.31
KDM5A P29375 1/20 0.31
KDM5C P41229 1/20 0.31
KMT2A Q03164 1/20 0.31
PAX8 Q06710 1/20 0.31
ALDH1A2 O94788 1/20 0.31
ALDH1A3 P47895 1/20 0.31
ADORA2A P29274 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
CASP3 P42574 1/20 0.30
SENP8 Q96LD8 1/20 0.30

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
SCHEMBL9753493 0.92 APP (0.40) APPALDH1A1RAB9ANPC1KDM4E
SCHEMBL8607791 0.81 APP (0.36) APPALDH1A1RAB9ANPC1KDM4E
SCHEMBL8610050 0.79 TBXAS1 (0.42) APPSMN1; SMN2
SCHEMBL9753486 0.79 APP (0.35) APP
SCHEMBL8607360 0.77 ALDH1A3 (0.45) APPALDH1A1RAB9ANPC1KDM4E
SCHEMBL8607307 0.77 APP (0.34) APPALDH1A1RAB9ANPC1KDM4E
SCHEMBL9753856 0.77 APP (0.35) APPALDH1A3
SCHEMBL8608796 0.74 FFAR1 (0.35) APPALDH1A1RAB9ANPC1KDM4E
SCHEMBL8607404 0.73 ALDH1A2 (0.33) ALDH1A1RAB9ANPC1KDM4ESMN1; SMN2
SCHEMBL8607472 0.73

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0436831-A2 Imidazo[1,2-a]pyridinylalkyl compounds for treatment of neurotoxic injury G.D. Searle & Co. (US) 1991-07-17 EP claimed
WO-1991008211-A1 IMIDAZO[1,2-a]PYRIDINYLALKYL COMPOUNDS FOR TREATMENT OF NEUROTOXIC INJURY G.D. SEARLE & CO. (US) 1991-06-13 WO claimed
EP-0436831-A2 Imidazo[1,2-a]pyridinylalkyl compounds for treatment of neurotoxic injury G.D. Searle & Co. (US) 1991-07-17 EP disclosed
WO-1991008211-A1 IMIDAZO[1,2-a]PYRIDINYLALKYL COMPOUNDS FOR TREATMENT OF NEUROTOXIC INJURY G.D. SEARLE & CO. (US) 1991-06-13 WO disclosed