SCHEMBL10107294

SCHEMBL10107294

COc1ccc(/C(C)=N/OCc2ccc(C#N)cc2)cc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.62
RAB9A P51151 2/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
MAPT P10636 1/20 0.50
CYP19A1 P11511 2/20 0.45
RECQL P46063 1/20 0.43
CCR5 P51681 2/20 0.42
P4HB P07237 1/20 0.42
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 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
SCHEMBL10102085 0.85 NPC1 (0.64) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL10106877 0.85 GAA (0.46) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL10106925 0.84 SMN1; SMN2 (0.49) NPC1RAB9ASMN1; SMN2L3MBTL1RECQL
SCHEMBL15255539 0.84 NPC1 (0.48) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL10106822 0.82 TUBB4A (0.42) NPC1RAB9ASMN1; SMN2L3MBTL1CYP19A1
SCHEMBL10107282 0.82 MAPT (0.49) NPC1RAB9ASMN1; SMN2MAPTP4HB
SCHEMBL10107226 0.80 MAOA (0.42) NPC1RAB9ARECQLPDE4APDE4B
SCHEMBL10106882 0.79 HTT (0.48) NPC1RAB9ASMN1; SMN2L3MBTL1MAPT
SCHEMBL10107036 0.79 RECQL (0.43) NPC1RAB9ASMN1; SMN2RECQLPDE4A
SCHEMBL10106910 0.77 NPC1 (0.46) NPC1RAB9ARECQLPDE4BTUBB4A

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 4 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-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
WO-2008124878-A1 NON-STEROIDAL COMPOUNDS CRYPTOPHARMA PTY LTD (AU) 2008-10-23 WO 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 3908/4885SMN1; SMN2 3060/4885

“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.