SCHEMBL23360754

SCHEMBL23360754

CCc1noc(-c2cc[c]cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
MAPT P10636 3/20 0.49
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 1/20 0.49
PKM P14618 1/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
NOTUM Q6P988 2/20 0.46
LMNA P02545 3/20 0.41
TP53 P04637 3/20 0.41
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
MAPK1 P28482 1/20 0.39
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
CASP3 P42574 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
NR1H4 Q96RI1 1/20 0.36

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
SCHEMBL91656 0.81 SMN1; SMN2 (0.70) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL27601076 0.81 ALDH1A1 (0.52) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL10053916 0.80 MAPT (0.57) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL15134753 0.80 RAB9A (0.61) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL4668238 0.80 RAB9A (0.54) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL19627022 0.79 NOTUM (0.70) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL9197723 0.79 NPC1 (0.53) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL14873226 0.77 NPC1 (0.54) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL14873195 0.76 RAB9A (0.56) SMN1; SMN2NPC1RAB9AMAPTALDH1A1
SCHEMBL91384 0.76 NPC1 (0.56) SMN1; SMN2NPC1RAB9AMAPTALDH1A1

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-20210147371-A1 OXADIAZOLINE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2021-05-20 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-20210147371-A1 OXADIAZOLINE DERIVATIVES DDT, FOXO3, PDCD4 SMN1; SMN2 1880/4885NPC1 3922/4885RAB9A 3058/4885

“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.