SCHEMBL10107282

SCHEMBL10107282

COC(=O)c1ccc(CO/N=C(\C)c2ccc(OC)c(O)c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
S1PR1 P21453 2/20 0.45
HPGD P15428 2/20 0.44
ALDH1A1 P00352 1/20 0.44
TP53 P04637 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
CKS1B P61024 1/20 0.44
SKP2 Q13309 1/20 0.44
HIF1A Q16665 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL15255544 0.87 S1PR1 (0.39) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL10102022 0.86 HPGD (0.45) MAPTCYP1A2CYP3A4CYP2C9CYP2C19
SCHEMBL10106877 0.86 GAA (0.46) MAPTCYP1A2CYP3A4SMN1; SMN2S1PR1
SCHEMBL10106822 0.85 TUBB4A (0.42) CYP1A2CYP3A4SMN1; SMN2S1PR1ALOX15
SCHEMBL10106925 0.85 SMN1; SMN2 (0.49) CYP1A2CYP3A4SMN1; SMN2S1PR1ALDH1A1
SCHEMBL15255539 0.85 NPC1 (0.48) MAPTSMN1; SMN2S1PR1HPGDNPC1
SCHEMBL10106882 0.82 HTT (0.48) MAPTSMN1; SMN2S1PR1ALDH1A1NPC1
SCHEMBL10107294 0.82 NPC1 (0.62) MAPTCYP1A2CYP3A4SMN1; SMN2S1PR1
SCHEMBL10107226 0.81 MAOA (0.42) CYP1A2CYP3A4S1PR1ALOX15ALOX12
SCHEMBL10107036 0.80 RECQL (0.43) CYP1A2CYP3A4SMN1; SMN2S1PR1ALOX15

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 MAPT 2433/4885CYP1A2 418/4885CYP3A4 500/4885

“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.