SCHEMBL5468424

SCHEMBL5468424

COc1ccc(NC(=O)c2c[c]ccc2O)cc1OC

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ TP53 P04637 1/20 0.56
▸ KMT2A Q03164 4/20 0.55
▸ MEN1 O00255 2/20 0.53
▸ HTT P42858 1/20 0.51
▸ POLB P06746 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ LMNA P02545 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MAOB P27338 2/20 0.48
▸ PDE4D Q08499 1/20 0.48
▸ TOP1 P11387 1/20 0.48
▸ PTGS2 P35354 1/20 0.48
▸ MAOA P21397 1/20 0.48
▸ CYP1A2 P05177 3/20 0.48
▸ CYP2C19 P33261 2/20 0.48

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
SCHEMBL5466979 0.89 KMT2A (0.47) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL5461688 0.87 HTT (0.53) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL5462330 0.83 PNLIP (0.62) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL5455080 0.82 RAB9A (0.59) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL5462595 0.82 SMN1; SMN2 (0.59) NPC1RAB9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL5464230 0.81 TP53 (0.59) NPC1RAB9ASMN1; SMN2ALDH1A1TP53
SCHEMBL5468300 0.80 SNCA (0.56) NPC1RAB9AKMT2AMEN1MAOB
SCHEMBL5468423 0.80 POLB (0.57) SMN1; SMN2ALDH1A1TP53KMT2AMEN1
SCHEMBL5460406 0.79 KCNMA1 (0.62) ALDH1A1KMT2AMEN1POLBMAPK1
SCHEMBL5463771 0.78 RAB9A (0.51) NPC1RAB9ASMN1; SMN2ALDH1A1TP53

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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 — — US disclosed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 — — EP 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 NPC1 3368/4885RAB9A 3765/4885SMN1; SMN2 2862/4885

“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.

Send feedback