SCHEMBL23015504

SCHEMBL23015504

COCc1cccc(C2=CCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 10/20 0.47
L3MBTL1 Q9Y468 1/20 0.43
ERN1 O75460 1/20 0.42
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41
BRD4 O60885 1/20 0.40
CREBBP Q92793 1/20 0.40
F2RL3 Q96RI0 1/20 0.37
CYP11B2 P19099 1/20 0.37
ACMSD Q8TDX5 1/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37

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
SCHEMBL16135204 0.79 HTR1A (0.44) HTR1AACMSD
SCHEMBL30302079 0.79 CHRNB4 (0.50) HTR1AACMSD
SCHEMBL5387084 0.79 HTR1A (0.44) HTR1AACMSD
SCHEMBL5383499 0.79 CHRNB4 (0.50) HTR1AACMSD
SCHEMBL29644212 0.77 AGXT (0.55) L3MBTL1ERN1BRD4CREBBP
SCHEMBL1338691 0.77 AGXT (0.55) L3MBTL1ERN1BRD4CREBBP
SCHEMBL5268060 0.76 NCOA1 (0.47) PDGFRBPDGFRA
SCHEMBL5266330 0.75 MAOB (0.49) HTR1ABRD4
SCHEMBL30317738 0.75 MAOB (0.49) HTR1ABRD4
SCHEMBL15725255 0.75 HTR1A (0.47) HTR1AACMSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10927105-B1 Pyrazole MAGL inhibitors LUNDBECK LA JOLLA RESEARCH CENTER, INC. (US) 2021-02-23 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-10927105-B1 Pyrazole MAGL inhibitors MGLL, PNLIP, LPL HTR1A 2852/4885L3MBTL1 1901/4885ERN1 1347/4885

“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.