SCHEMBL10101769

SCHEMBL10101769

C/C(=N\OCc1ccc(C)cc1)c1cc(O)c(C)cc1-c1ccc(C)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 7/20 0.42
L3MBTL1 Q9Y468 4/20 0.42
MAPT P10636 3/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
BACE1 P56817 1/20 0.38
CA12 O43570 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 2/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MMP12 P39900 1/20 0.33
MMP13 P45452 1/20 0.33
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
PPARD Q03181 1/20 0.32

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
SCHEMBL10101760 0.94 L3MBTL1 (0.42) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10101774 0.94 BACE1 (0.40) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10101765 0.94 CA12 (0.44) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10101753 0.94 MAPK1 (0.41) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10101757 0.93 S1PR1 (0.41) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10101773 0.91 S1PR1 (0.43) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10102149 0.89 SMN1; SMN2 (0.40) S1PR1L3MBTL1MAPTGAANPC1
SCHEMBL10101767 0.89 S1PR1 (0.40) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10101752 0.89 POLB (0.41) S1PR1L3MBTL1MAPTPOLBGAA
SCHEMBL10101751 0.83 L3MBTL1 (0.43) S1PR1L3MBTL1MAPTPOLBGAA

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 S1PR1 909/4885L3MBTL1 4843/4885MAPT 2433/4885

“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.