SCHEMBL25135437

SCHEMBL25135437

COC(=O)C12CCC(CCC(C)C)(CC1)C2

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
CHRM1 P11229 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
LMNA P02545 1/20 0.30
NLRP3 Q96P20 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30

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
SCHEMBL10160182 0.83 LMNA (0.35) CYP4F2CYP4A11CHRM1CYP2D6CYP2C19
SCHEMBL24960420 0.81 SCN1A (0.31) CHRM1CYP2D6CYP2C19
SCHEMBL23624135 0.81 CYP4F2 (0.34) CYP4F2CYP4A11CHRM1LMNANPSR1
SCHEMBL30834944 0.81 CYP4F2 (0.41) CYP4F2CYP4A11CHRM1LMNANPSR1
SCHEMBL25135435 0.81 CYP2D6 (0.33) CYP2D6CYP2C19FFAR4
SCHEMBL25415119 0.79 CYP4F2 (0.33) CYP4F2CYP4A11CHRM1LMNANPSR1
SCHEMBL23639717 0.79 CHRM1 (0.35) CYP4F2CYP4A11CHRM1LMNANPSR1
SCHEMBL24960887 0.78 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL16055077 0.77 CYP4F2 (0.36) CYP4F2CYP4A11CHRM1LMNANPSR1
SCHEMBL13593976 0.77 PKM (0.35) CYP4F2CYP4A11CHRM1LMNANPSR1

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-20230105212-A1 BIPHENYL DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2023-04-06 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-20230105212-A1 BIPHENYL DERIVATIVE INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF CYP51A1, TMBIM6, CYP46A1 CYP4F2 21/4885CYP4A11 18/4885CHRM1 4880/4885

“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.