SCHEMBL15064166

SCHEMBL15064166

c1ccc2oc(C34CC5CC(CC(C5)C3)C4)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53
NPC1 O15118 5/20 0.48
RAB9A P51151 5/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
TSHR P16473 2/20 0.48
CHRM2 P08172 2/20 0.48
CHRM4 P08173 2/20 0.48
CHRM5 P08912 2/20 0.48
CHRM1 P11229 2/20 0.48
CHRM3 P20309 2/20 0.48
KDM1A O60341 1/20 0.44
CHRNA7 P36544 1/20 0.43
HTR3A P46098 1/20 0.43
MAPT P10636 3/20 0.42
PSMB8 P28062 1/20 0.40
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 3/20 0.39

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
SCHEMBL15081865 0.82 CHRM2 (0.45) HTTNPC1RAB9ASMN1; SMN2TSHR
SCHEMBL6591574 0.78 STS (0.52) HTTNPC1RAB9ASMN1; SMN2TSHR
SCHEMBL12104302 0.76 HSD11B1 (0.39) HTTNPC1RAB9ASMN1; SMN2CHRM2
SCHEMBL19798473 0.74 NPC1 (0.47) NPC1RAB9ASMN1; SMN2CHRNA7HTR3A
SCHEMBL21814874 0.74 APP (0.45) HTTALDH1A1KDM4EMEN1KMT2A
SCHEMBL22791795 0.72 NPC1 (0.47) NPC1RAB9ASMN1; SMN2MAPTALDH1A1
SCHEMBL19798477 0.70 CHRNA7 (0.51) HTTNPC1RAB9ASMN1; SMN2TSHR
SCHEMBL28525201 0.69 SMN1; SMN2 (0.55) HTTNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL23758327 0.69 MAPT (0.46) NPC1RAB9ASMN1; SMN2CHRM2CHRM4
SCHEMBL22127250 0.69 KDM1A (0.47) HTTNPC1RAB9ASMN1; SMN2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023092175-A1 NOVEL P2X7 RECEPTOR ANTAGONISTS THE UNIVERSITY OF SYDNEY (AU) 2023-06-01 WO disclosed
US-20130172570-A1 METHOD OF MAKING BENZAZOLES US GOVERNMENT AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2013-07-04 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-20130172570-A1 METHOD OF MAKING BENZAZOLES NBAS, CBR3, CBR1 HTT 1164/4885NPC1 163/4885RAB9A 2393/4885

“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.