SCHEMBL10102036

SCHEMBL10102036

C/C(=N\OCc1ccccc1)c1ccc(C)c(O)c1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PPARG P37231 13/20 0.49
PPARA Q07869 12/20 0.49
LMNA P02545 2/20 0.46
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
S1PR1 P21453 2/20 0.44
HPGD P15428 1/20 0.40

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
SCHEMBL10101726 0.89 S1PR1 (0.48) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL15851102 0.89 NPC1 (0.50) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL10241911 0.89 NPC1 (0.50) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL10101740 0.88 NPC1 (0.48) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL10102038 0.86 SMN1; SMN2 (0.51) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL10102011 0.85 NPC1 (0.46) NPC1RAB9ASMN1; SMN2PPARGPPARA
SCHEMBL15255539 0.83 NPC1 (0.48) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL10102056 0.83 SMN1; SMN2 (0.44) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL7674107 0.83 NPC1 (0.48) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG
SCHEMBL10102022 0.83 HPGD (0.45) NPC1RAB9AL3MBTL1SMN1; SMN2PPARG

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
US-8536157-B2 Non-steroidal compounds THE UNIVERSITY OF MELBOURNE (AU) 2013-09-17 US disclosed
US-20120046255-A1 NON-STEROIDAL COMPOUNDS THE UNIVERSITY OF MELBOURNE of ROYAL PARADE PARKVILLE (AU) 2012-02-23 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-20120046255-A1 NON-STEROIDAL COMPOUNDS PTGES2, PTGES, PTGES3 NPC1 357/4885RAB9A 3908/4885L3MBTL1 4843/4885

“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.