SCHEMBL8202437

SCHEMBL8202437

COC(=O)c1ccc(N2C(=O)C3(CCNCC3)C2c2ccc(Cl)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 12/20 0.45
MAPT P10636 2/20 0.44
TP53 P04637 1/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TRPV1 Q8NER1 2/20 0.39
TSHR P16473 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL8202849 0.83 CACNA1H (0.49) CACNA1HMAPTTP53SMN1; SMN2KMT2A
SCHEMBL8209942 0.82 HSD11B1 (0.50) CACNA1HSMN1; SMN2
SCHEMBL8210233 0.79 CACNA1H (0.47) CACNA1HALDH1A1
SCHEMBL12876586 0.79 CACNA1H (0.61) CACNA1HTRPV1
SCHEMBL8202103 0.77 CACNA1H (0.45) CACNA1HMAPTSMN1; SMN2GAATSHR
SCHEMBL8201959 0.73 CACNA1H (0.62) CACNA1HTSHR
SCHEMBL7814794 0.72 HSD11B1 (0.54) CACNA1HTP53POLBKMT2ATSHR
SCHEMBL8202443 0.72 TRPV1 (0.49) CACNA1HPOLBSMN1; SMN2TRPV1TSHR
SCHEMBL26822409 0.71 DRD2 (0.40) CACNA1H
SCHEMBL12890375 0.70 SMN1; SMN2 (0.42) POLBSMN1; SMN2GAAKMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7884080-B2 Administering an azetidinone compound for treating a disorder of lipid metabolism, pain, diabetes, a vascular condition, demyelination or nonalcoholic fatty liver disease; T-type calcium channel blocking agent, an antagonist of TRPV1, an agonist of TRPV1, of GPR119, antagonist of NPCL1 SCHERING PLOUGH CORPORATION (US) 2011-02-08 US disclosed
US-20080076751-A1 Azetidinone Derivatives and Methods of Use Thereof MERCK SHARP & DOHME CORP. 2008-03-27 US disclosed
WO-2008033464-A2 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF DISORDERS OF THE LIPID METABOLISM SCHERING CORPORATION (US) 2008-03-20 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-20080076751-A1 Azetidinone Derivatives and Methods of Use Thereof LIPC, ZDHHC20, FABP1 CACNA1H 2929/4885MAPT 4233/4885TP53 4628/4885

“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.