SCHEMBL31124103

SCHEMBL31124103

CC1=CC=CC(O)(C(=O)O)C1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GLA P06280 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 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
SCHEMBL8858302 0.78
SCHEMBL11997386 0.76 KDM4E (0.33) KDM4EALDH1A1GLAPOLBGAA
SCHEMBL31261123 0.76 KDM4E (0.30) KDM4EALDH1A1GLAPOLBGAA
SCHEMBL2306809 0.74
SCHEMBL5048472 0.72
SCHEMBL31295612 0.71 TP53 (0.32)
SCHEMBL9006818 0.71 THRB (0.35) ALDH1A1
SCHEMBL31588943 0.68 CYP3A4 (0.33)
SCHEMBL27807528 0.68
SCHEMBL10873900 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4692041-A1 METHOD FOR PRODUCING BIO-DERIVED ESTER COMPOUND, BIO-DERIVED ESTER COMPOUND PRODUCED THEREBY, COSMETIC OR DETERGENT CONTAINING BIO-DERIVED ESTER COMPOUND, AND METHOD FOR REDUCING ODOR OF ESTER COMPOUND ADEKA CORPORATION (JP) 2026-02-11 EP disclosed
WO-2024204392-A1 METHOD FOR PRODUCING BIO-DERIVED ESTER COMPOUND, BIO-DERIVED ESTER COMPOUND PRODUCED THEREBY, COSMETIC OR DETERGENT CONTAINING BIO-DERIVED ESTER COMPOUND, AND METHOD FOR REDUCING ODOR OF ESTER COMPOUND 株式会社ADEKA 2024-10-03 WO disclosed