SCHEMBL7110319

SCHEMBL7110319

C#CCN1CCC(Nc2ccccc2Cl)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.48
KMT2A Q03164 1/20 0.47
MAOB P27338 10/20 0.47
MAOA P21397 8/20 0.47
PKM P14618 1/20 0.46
ALDH1A1 P00352 1/20 0.45
BCHE P06276 2/20 0.44
MAPK1 P28482 1/20 0.43
ROCK2 O75116 1/20 0.41
CCR2 P41597 1/20 0.41
ROCK1 Q13464 1/20 0.41

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
SCHEMBL7107539 0.86 GAA (0.46) KDM4EGAAKMT2APKMALDH1A1
SCHEMBL7108431 0.83 KDM4E (0.44) KDM4EGAAKMT2APKMALDH1A1
SCHEMBL7110318 0.78 POLB (0.58) MAOBMAOAALDH1A1BCHEROCK2
SCHEMBL10842161 0.77 GAA (0.58) KDM4EGAAKMT2AALDH1A1
SCHEMBL19908801 0.76 POLB (0.56) KDM4EGAAKMT2APKMALDH1A1
SCHEMBL19403829 0.73 KDM4E (0.58) KDM4EGAAKMT2APKMALDH1A1
SCHEMBL17845025 0.72 MCHR1 (0.64) KDM4E
SCHEMBL5046395 0.72 KDM4E (0.61) KDM4EGAAKMT2APKMALDH1A1
SCHEMBL27833486 0.72 KMT2A (0.64) GAAKMT2APKMALDH1A1
SCHEMBL7400019 0.71 PKM (0.47) KDM4EGAAKMT2APKMALDH1A1

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-20030105133-A1 4-Substituted piperidine analogs and their use as subtype selective NMDA receptor, antagonists BIGGE CHRISTOPHER F (US) 2003-06-05 US claimed
US-20030105133-A1 4-Substituted piperidine analogs and their use as subtype selective NMDA receptor, antagonists BIGGE CHRISTOPHER F (US) 2003-06-05 US disclosed
US-6448270-B1 BICYCLIC HETEROARYL ACETYLENES; NEUROPROTECTIVE AGENTS; STROKE, CEREBRAL ISCHEMIA, CENTRAL NERVOUS SYSTEM TRAUMA, HYPOGLYCEMIA, ANXIETY, CONVULSIONS, AMINOGLYCOSIDE ANTIBIOTIC INDUCED HEARING LOSS, MIGRAINES, CHRONIC PAIN, GLAUCOMA WARNER-LAMBERT COMPANY 2002-09-10 US disclosed
US-6130234-A 4-substituted piperidine analogs and their use as subtype selective NMDA receptor antagonists WARNER-LAMBERT COMPANY (US) 2000-10-10 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-20030105133-A1 4-Substituted piperidine analogs and their use as subtype selective NMDA receptor, antagonists GRIN3B, OPRM1, GRIN3A KDM4E 955/4885GAA 510/4885KMT2A 1232/4885

“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.