SCHEMBL7976381

SCHEMBL7976381

O=C(CCCNC(=O)c1cc(C(F)(F)F)ccc1Cl)Oc1c(Cl)cc(OCC=C(Cl)Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
P2RX7 Q99572 2/20 0.38
JAK2 O60674 1/20 0.37
JAK1 P23458 1/20 0.37
TYK2 P29597 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
LMNA P02545 1/20 0.37
HPGD P15428 1/20 0.37
RHOC P08134 1/20 0.37
RHOA P61586 1/20 0.37
CRHR1 P34998 8/20 0.36
MRGPRX4 Q96LA9 2/20 0.36
CRHR2 Q13324 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA3 P07451 1/20 0.35

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
SCHEMBL7979244 0.91 GAA (0.38) HDAC1HDAC6GAAMAPTHTT
SCHEMBL7979400 0.91 FLT1 (0.37) HDAC1HDAC6GAAMAPTHTT
SCHEMBL7982289 0.89 HDAC1 (0.45) HDAC1HDAC6P2RX7JAK2JAK1
SCHEMBL7977673 0.88 KMT2A (0.45) P2RX7MAPTHTTHPGDCA12
SCHEMBL7965923 0.88 MAPT (0.46) GAAMAPTHTTLMNAHPGD
SCHEMBL7976379 0.85 HDAC1 (0.39) HDAC1MAPT
SCHEMBL7979399 0.82 MAPT (0.34) HDAC1GAAMAPTHTTLMNA
SCHEMBL7979241 0.82 MAPT (0.37) HDAC1GAAMAPTHTTLMNA
SCHEMBL7977813 0.82 FOLH1 (0.40) HDAC1MAPTCA12CA1CA2
SCHEMBL7965747 0.80 RHOC (0.42) HDAC1HDAC6GAAMAPTHTT

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 4 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