SCHEMBL2149343

SCHEMBL2149343

CCCCCCCCOc1c(C(C)(C)C)cc(C(O)(c2cc(C(C)(C)C)c(OCCCCCCCC)c(C(C)(C)C)c2)C(N)CC(C)C)cc1C(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LNPEP Q9UIQ6 8/20 0.43
RXRA P19793 4/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
PPARG P37231 2/20 0.34
THRA P10827 2/20 0.33
THRB P10828 2/20 0.33
S1PR1 P21453 1/20 0.32
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32

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
SCHEMBL2150165 0.95 LNPEP (0.38) LNPEPRXRARXRBRXRGPPARG
SCHEMBL2235018 0.89 RXRA (0.37) LNPEPRXRARXRBRXRGPPARG
SCHEMBL2232312 0.87 RXRA (0.38) LNPEPRXRARXRBRXRGPPARG
SCHEMBL2149457 0.85 RXRA (0.37) LNPEPRXRARXRBRXRGPPARG
SCHEMBL2166401 0.83 RXRA (0.39) RXRARXRBRXRGPPARGTHRA
SCHEMBL2150167 0.83 RXRA (0.36) LNPEPRXRARXRBRXRGPPARG
SCHEMBL2232073 0.82 RXRA (0.40) RXRARXRBRXRGPPARGTHRA
SCHEMBL2235395 0.82 RXRA (0.40) RXRARXRBRXRGPPARGTHRA
SCHEMBL2150047 0.81 KDM4E (0.48) LNPEPRXRARXRBRXRGPPARG
SCHEMBL2150552 0.80 DHFR (0.34) LNPEPRXRAPPARG

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
EP-2341042-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOPROPANE CARBOXYLIC ACID ESTER COMPOUND, ASYMMETRIC COPPER COMPLEX, AND OPTICALLY ACTIVE SALICYLIDENEAMINOALCOHOL COMPOUND SUMITOMO CHEMICAL CO (JP) 2019-03-20 EP disclosed
US-8680328-B2 Method for producing optically active cyclopropane carboxylic acid ester compound, asymmetric copper complex, and optically active salicylideneaminoalcohol compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-03-25 US disclosed
US-20110166372-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOPROPANE CARBOXYLIC ACID ESTER COMPOUND, ASYMMETRIC COPPER COMPLEX, AND OPTICALLY ACTIVE SALICYLIDENEAMINOALCOHOL COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-07 US disclosed
EP-2341042-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOPROPANE CARBOXYLIC ACID ESTER COMPOUND, ASYMMETRIC COPPER COMPLEX, AND OPTICALLY ACTIVE SALICYLIDENEAMINOALCOHOL COMPOUND Sumitomo Chemical Company, Limited (JP) 2011-07-06 EP 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-20110166372-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE CYCLOPROPANE CARBOXYLIC ACID ESTER COMPOUND, ASYMMETRIC COPPER COMPLEX, AND OPTICALLY ACTIVE SALICYLIDENEAMINOALCOHOL COMPOUND ALDH18A1, ALDH3A1, DECR1 LNPEP 4451/4885RXRA 734/4885RXRB 1164/4885

“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.