SCHEMBL9724914

SCHEMBL9724914

CC(C)[C@H](Cl)C(=O)Oc1ccc(C(=O)Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.51
KMT2A Q03164 4/20 0.37
PARP10 Q53GL7 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
ESR1 P03372 1/20 0.35
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
PRSS1 P07477 1/20 0.33
ACR P10323 1/20 0.33

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
SCHEMBL9724919 1.00 ELANE (0.51) ELANEKMT2APARP10ATML3MBTL1
SCHEMBL9724823 0.86 KMT2A (0.53) ELANEKMT2APARP10ALDH1A1MAPT
SCHEMBL9724826 0.86 KMT2A (0.53) ELANEKMT2APARP10ALDH1A1MAPT
SCHEMBL8346992 0.84 ELANE (0.47) ELANEKMT2AATML3MBTL1MAPT
SCHEMBL8346993 0.84 ELANE (0.47) ELANEKMT2AATML3MBTL1MAPT
SCHEMBL9724876 0.82 HSD17B10 (0.58) ELANEKMT2AMAPTHSD17B10
SCHEMBL9724878 0.82 HSD17B10 (0.58) ELANEKMT2AMAPTHSD17B10
SCHEMBL10423088 0.78 ELANE (0.50) ELANEKMT2APARP10ALDH1A1MAPT
SCHEMBL10423087 0.78 ELANE (0.50) ELANEKMT2APARP10ALDH1A1MAPT
SCHEMBL9803070 0.78 ALOX5 (0.44) ELANESMN1; SMN2RAB9A

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 6 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-4961876-A OPTO-ELECTRONIC DISPLAY VEB WERK FUER FERNSEHELEKTRONIK IM VEB KOMBINAT MIKROELEKTRONIK (DD) 1990-10-09 US 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