SCHEMBL30393045

SCHEMBL30393045

Oc1ccc(-c2nc3c4ccccc4ncn3n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.59
RAB9A P51151 1/20 0.59
ADORA3 P0DMS8 4/20 0.50
ADORA2A P29274 1/20 0.50
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
MAPT P10636 2/20 0.47
GAA P10253 2/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ADORA1 P30542 1/20 0.44
BCHE P06276 1/20 0.42
BMP4 P12644 1/20 0.40
KDM4E B2RXH2 2/20 0.39
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
KDR P35968 1/20 0.39
KDM1A O60341 1/20 0.38
DHODH Q02127 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
SCHEMBL30394119 0.86 NPC1 (0.59) NPC1RAB9AADORA3ADORA2AKMT2A
SCHEMBL30393845 0.86 NPC1 (0.59) NPC1RAB9AADORA3MEN1KMT2A
SCHEMBL30393377 0.82 NPC1 (0.55) NPC1RAB9AADORA3ADORA2AMAPT
SCHEMBL30393295 0.82 NPC1 (0.55) NPC1RAB9AADORA3ADORA2AMAPT
SCHEMBL30394179 0.82 NPC1 (0.55) NPC1RAB9AADORA3ADORA2AMEN1
SCHEMBL30393274 0.82 MAPT (0.58) NPC1RAB9AADORA3MAPTSMN1; SMN2
SCHEMBL30393317 0.82 NPC1 (0.55) NPC1RAB9AADORA3ADORA2AMAPT
SCHEMBL30393883 0.82 NPC1 (0.52) NPC1RAB9AADORA3ADORA2AMEN1
SCHEMBL30393368 0.80 NPC1 (0.71) NPC1RAB9AMEN1KMT2AMAPT
SCHEMBL30393310 0.80 NPC1 (0.63) NPC1RAB9AADORA3MEN1KMT2A

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
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES BAYER AKTIENGESELLSCHAFT (DE) 2023-04-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230113037-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES AHR, HRH4, HRH1 NPC1 1806/4885RAB9A 902/4885ADORA3 34/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.