SCHEMBL9653264

SCHEMBL9653264

CCc1c(Cl)ccc(C(OC(C)=O)=C(C(=O)O)C(=O)N(C)C)c1Cl

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.31
MEN1 O00255 1/20 0.30
ABCC3 O15438 1/20 0.30
PLIN1 O60240 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
GSTA1 P08263 1/20 0.30
GSTP1 P09211 1/20 0.30
MAPT P10636 1/20 0.30
HSPD1 P10809 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 1/20 0.30
RECQL P46063 1/20 0.30
MAP2K6 P52564 1/20 0.30
HSPE1 P61604 1/20 0.30
GSTO1 P78417 1/20 0.30
PLIN5 Q00G26 1/20 0.30
KMT2A Q03164 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
SCHEMBL9652739 0.87 ALDH1A1 (0.33) KDM4EALDH1A1HTTKMT2A
SCHEMBL9653793 0.87 LMNA (0.34) KDM4EALDH1A1MEN1LMNATSHR
SCHEMBL10651984 0.86 CYP1A2 (0.32) KDM4EALDH1A1HTTLMNATSHR
SCHEMBL9653254 0.82 HTT (0.35) KDM4EALDH1A1HTTLMNA
SCHEMBL9653700 0.80 CYP1A2 (0.36) KDM4EALDH1A1MEN1MAPTCYP2C9
SCHEMBL9652720 0.79 LMNA (0.33) KDM4EALDH1A1HTTLMNAMAPT
SCHEMBL9273956 0.75 CYP4F2 (0.34) ALDH1A1HTTMEN1ABCC3PLIN1
SCHEMBL9651900 0.74 HTT (0.33) HTT
SCHEMBL9653908 0.74 KMT2A (0.38) KDM4EALDH1A1MAPTCYP2C9TSHR
SCHEMBL9651973 0.74 ALDH1A1 (0.34) KDM4EALDH1A1MEN1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0213892-B1 HERBICIDALLY ACTIVE ENOLS ROHM AND HAAS COMPANY (US) 1992-03-25 EP disclosed
US-4781750-A Herbicidally active enols ROHM AND HAAS COMPANY (US) 1988-11-01 US disclosed
EP-0213892-A2 Herbicidally active enols ROHM AND HAAS COMPANY (US) 1987-03-11 EP disclosed