SCHEMBL577642

SCHEMBL577642

Cc1cc(O)nn1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.56
CYP1A2 P05177 1/20 0.47
CYP2C19 P33261 1/20 0.47
RIPK1 Q13546 10/20 0.47
NPY5R Q15761 1/20 0.47
FCGR1A P12314 1/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
KDM4C Q9H3R0 1/20 0.45
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
NTRK1 P04629 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL23401857 0.84 ALDH1A1 (0.45) MAPK1CYP1A2CYP2C19RIPK1NPC1
SCHEMBL23400514 0.83 ALDH1A1 (0.51) MAPK1NPY5RNPC1RAB9ALMNA
SCHEMBL10715419 0.81 MAPK1 (0.42) MAPK1CYP1A2CYP2C19FCGR1ANPC1
SCHEMBL31189136 0.80 RAB9A (0.54) CYP1A2CYP2C19NPC1RAB9ALMNA
SCHEMBL526575 0.80 RAB9A (0.54) CYP1A2CYP2C19NPC1RAB9ALMNA
SCHEMBL964125 0.79 MAPK1 (0.66) MAPK1CYP1A2CYP2C19FCGR1ANPC1
SCHEMBL23401297 0.78 LMNA (0.53) NPC1RAB9ALMNATSHRSMN1; SMN2
SCHEMBL23401870 0.77 ALDH1A1 (0.46) LMNATSHR
SCHEMBL23401080 0.77 ALDH1A1 (0.50) MAPK1CYP1A2CYP2C19FCGR1ANPC1
SCHEMBL6449791 0.77 LMNA (0.56) MAPK1LMNATSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025049419-A1 PYRAZOLYL COMPOUNDS AS EMOPAMIL BINDING PROTEIN INHIBITORS GENZYME CORPORATION (US) 2025-03-06 WO disclosed
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed
US-9035070-B2 Process for the preparation of 1-aryl-pyrazol-3-one intermediates useful in the synthesis of sigma receptors inhibitors Esteve Química, S.A. (ES) 2015-05-19 US disclosed
EP-2598469-B1 PROCESS FOR THE PREPARATION OF 1-ARYL-PYRAZOL-3-ONE INTERMEDIATES USEFUL IN THE SYNTHESIS OF SIGMA RECEPTORS INHIBITORS ESTEVE QUÍMICA S A (ES) 2014-07-23 EP disclosed
US-20130184472-A1 Process for the Preparation of 1-ARYL-PYRAZOL-3-ONE Intermediates Useful in the Synthesis of SIGMA Receptors Inhibitors ESTEVE QUIMICA, S.A. (ES) 2013-07-18 US disclosed
EP-2418192-A1 Intermediates for the preparation of 1-aryl-pyrazol-3-one compounds useful as sigma receptors inhibitors Esteve Química, S.A. (ES) 2012-02-15 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-20130184472-A1 Process for the Preparation of 1-ARYL-PYRAZOL-3-ONE Intermediates Useful in the Synthesis of SIGMA Receptors Inhibitors SIGMAR1, OPRK1, OPRM1 MAPK1 329/4885CYP1A2 46/4885CYP2C19 168/4885

“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.