SCHEMBL13548043

SCHEMBL13548043

Cc1cc(-c2ccc(Cl)cc2)c(C)cc1C1=C(O)C2(CCCCCC2)OC1=O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.42
LMNA P02545 1/20 0.42
ACACB O00763 5/20 0.39
ACACA Q13085 5/20 0.39
CNR1 P21554 3/20 0.39
CNR2 P34972 3/20 0.39
ALDH1A1 P00352 1/20 0.35
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
IL2 P60568 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL13548038 1.00 THRB (0.42) THRBLMNAACACBACACACNR1
SCHEMBL2353015 0.96 THRB (0.41) THRBLMNAACACBACACACNR1
SCHEMBL13548099 0.94 THRB (0.40) THRBLMNAACACBACACACNR1
SCHEMBL2349821 0.89 ACACB (0.49) THRBLMNAACACBACACACNR1
SCHEMBL13548083 0.89 THRB (0.41) THRBLMNAACACBACACACNR1
SCHEMBL13548098 0.89 THRB (0.41) THRBLMNAACACBACACACNR1
SCHEMBL13548037 0.89 ACACB (0.38) THRBLMNAACACBACACACNR1
SCHEMBL13548029 0.89 ACACB (0.38) THRBLMNAACACBACACACNR1
SCHEMBL2356692 0.89 ACACB (0.49) THRBLMNAACACBACACACNR1
SCHEMBL13548031 0.88 CNR1 (0.40) THRBLMNAACACBACACACNR1

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-20100022527-A1 BIPHENYL SUBSTITUTED SPIROTETRONIC ACIDS AND THEIR USE FOR THE TREATMENT OF RETROVIRAL DISEASES AICURIS GMBH & CO. KG (DE) 2010-01-28 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-20100022527-A1 BIPHENYL SUBSTITUTED SPIROTETRONIC ACIDS AND THEIR USE FOR THE TREATMENT OF RETROVIRAL DISEASES DHFR, RORA, CYP2A6 THRB 245/4885LMNA 1617/4885ACACB 2720/4885

“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.