SCHEMBL7979343

SCHEMBL7979343

CCc1cc(OCC=C(Cl)Cl)cc(C)c1OCCCC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.43
FFAR4 Q5NUL3 8/20 0.42
CYP3A4 P08684 1/20 0.42
KCNH2 Q12809 1/20 0.42
CACNA1C Q13936 1/20 0.42
SCN5A Q14524 1/20 0.42
TSHR P16473 1/20 0.39
FFAR1 O14842 4/20 0.37
HTT P42858 1/20 0.37
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
PLA2G2A P14555 1/20 0.35
NR1H4 Q96RI1 1/20 0.34

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
SCHEMBL7975821 0.96 MCL1 (0.42) MCL1FFAR4CYP3A4KCNH2CACNA1C
SCHEMBL7977381 0.91 FFAR4 (0.48) MCL1FFAR4CYP3A4KCNH2CACNA1C
SCHEMBL7979298 0.88 MCL1 (0.40) MCL1FFAR4CYP3A4KCNH2CACNA1C
SCHEMBL7977851 0.88 MCL1 (0.47) MCL1FFAR4CYP3A4KCNH2CACNA1C
SCHEMBL8406003 0.88 HTT (0.37) MCL1FFAR4CYP3A4KCNH2CACNA1C
SCHEMBL7978808 0.87 FFAR4 (0.47) MCL1FFAR4CYP3A4KCNH2CACNA1C
SCHEMBL8409335 0.86 HTT (0.36) MCL1TSHRHTT
SCHEMBL8405371 0.86 HTT (0.36) MCL1FFAR4CYP3A4KCNH2CACNA1C
SCHEMBL8408512 0.85 HTT (0.36) MCL1TSHRHTTTHRATHRB
SCHEMBL7632961 0.85 HTT (0.36) MCL1HTTTHRATHRBPLA2G2A

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-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed
EP-0824514-B1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL CO (JP) 2000-09-06 EP disclosed
US-6028100-A Dihalopropene compounds, insecticides containing them as active ingredients, and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-02-22 US disclosed
US-5952386-A EXCELLENT INSECTICIDAL ACTIVITY FOR THE CONTROL OF NOXIOUS INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-14 US disclosed
EP-0824514-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1998-02-25 EP disclosed
WO-1996033160-A1 DIHALOPROPENE COMPOUNDS, INSECTICIDES CONTAINING THEM AS ACTIVE INGREDIENTS, AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-10-24 WO disclosed