SCHEMBL8632072

SCHEMBL8632072

COc1cc(OC)cc(Oc2ccc(O)c(C(F)(F)F)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 1/20 0.44
AR P10275 6/20 0.44
ALDH1A1 P00352 2/20 0.43
GAA P10253 2/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41
TUBB2B Q9BVA1 1/20 0.41

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
SCHEMBL8635438 0.92 LTA4H (0.50) ESRRAARALDH1A1GAAHSD17B10
SCHEMBL8633891 0.90 SMN1; SMN2 (0.50) ESRRAARALDH1A1GAAKDM4E
SCHEMBL755578 0.88 ALDH1A1 (0.53) ARALDH1A1GAACA1CA2
SCHEMBL16648399 0.88 ESRRA (0.49) ESRRAARALDH1A1THRB
SCHEMBL8635216 0.84 TUBB4A (0.50) ESRRAARALDH1A1GAACA1
SCHEMBL8632090 0.80 AR (0.47) ESRRAARALDH1A1GAALTA4H
SCHEMBL8635974 0.79 ESRRA (0.46) ESRRAARCA1CA2LTA4H
SCHEMBL8633068 0.79 AR (0.49) ESRRAARLTA4HTHRBAKR1C3
SCHEMBL8637195 0.79 AR (0.39) ESRRAARALDH1A1GAAHSD17B10
SCHEMBL12733577 0.79 ESRRA (0.54) ESRRAARALDH1A1GAAHSD17B10

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
EP-0648729-B1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL CO (JP) 1998-07-15 EP disclosed
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed
EP-0648729-A1 Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-04-19 EP disclosed