SCHEMBL9724878

SCHEMBL9724878

CC(C)C(Cl)C(=O)Oc1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.58
KMT2A Q03164 1/20 0.49
RARB P10826 5/20 0.48
SRD5A2 P31213 1/20 0.48
ELANE P08246 2/20 0.47
RXRA P19793 3/20 0.47
RXRB P28702 2/20 0.47
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
MAPK1 P28482 1/20 0.43
RXRG P48443 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL9724876 1.00 HSD17B10 (0.58) HSD17B10KMT2ARARBSRD5A2ELANE
SCHEMBL9724826 0.95 KMT2A (0.53) HSD17B10KMT2ARARBSRD5A2ELANE
SCHEMBL9724823 0.95 KMT2A (0.53) HSD17B10KMT2ARARBSRD5A2ELANE
SCHEMBL8346993 0.90 ELANE (0.47) HSD17B10KMT2AELANELMNAGAA
SCHEMBL8346992 0.90 ELANE (0.47) HSD17B10KMT2AELANELMNAGAA
SCHEMBL9803070 0.84 ALOX5 (0.44) ELANEMAPK1
SCHEMBL9724919 0.82 ELANE (0.51) HSD17B10KMT2AELANEMAPT
SCHEMBL9724914 0.82 ELANE (0.51) HSD17B10KMT2AELANEMAPT
SCHEMBL9802965 0.80 ACACB (0.47) KMT2ALMNAGAAMAPT
SCHEMBL9405577 0.80 MAPT (0.51) HSD17B10KMT2ARARBSRD5A2ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5100579-A POLYPHENYL-BASED ESTER COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME AJINOMOTO CO., INC. (JP) 1992-03-31 US disclosed
EP-0191600-B1 POLYPHENYL-BASED ESTER COMPOUNDS AND LIQUID CRYSTAL COMPOSITIONS CONTAINING SAME AJINOMOTO CO., INC. (JP) 1991-12-27 EP disclosed
US-4911861-A Mixture of at least two components AJINOMOTO CO., INC. (JP) 1990-03-27 US disclosed
US-4728458-A FERROELECTRIC AJINOMOTO CO., LTD. (JP) 1988-03-01 US disclosed
EP-0191600-A2 Polyphenyl-based ester compounds and liquid crystal compositions containing same AJINOMOTO CO., INC. (JP) 1986-08-20 EP disclosed