SCHEMBL8636220

SCHEMBL8636220

Oc1ccc(Oc2cccc(-c3ccccc3)c2)cc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 2/20 0.46
▸ HSD17B2 P37059 2/20 0.46
▸ AR P10275 4/20 0.44
▸ FFAR1 O14842 1/20 0.44
▸ FFAR4 Q5NUL3 1/20 0.44
▸ NR1H2 P55055 6/20 0.43
▸ NR1H3 Q13133 6/20 0.43
▸ ESRRA P11474 1/20 0.43
▸ THRA P10827 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ ALOX5 P09917 1/20 0.41
▸ CETP P11597 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ TRPA1 O75762 1/20 0.39

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
SCHEMBL8633991 0.91 HSD17B1 (0.47) HSD17B1HSD17B2ARFFAR1FFAR4
SCHEMBL8632090 0.89 AR (0.47) HSD17B1HSD17B2ARNR1H2NR1H3
SCHEMBL8633068 0.89 AR (0.49) ARNR1H2ESRRATHRATHRB
SCHEMBL16648399 0.83 ESRRA (0.49) HSD17B1HSD17B2ARESRRATHRA
SCHEMBL8636487 0.81 THRA (0.46) HSD17B1HSD17B2ARTHRATHRB
SCHEMBL27546220 0.80 HSD17B1 (0.60) HSD17B1HSD17B2ARALOX5
SCHEMBL8633891 0.80 SMN1; SMN2 (0.50) ARESRRA
SCHEMBL8633887 0.80 AR (0.63) HSD17B1HSD17B2ARESRRATHRA
SCHEMBL8632004 0.80 AR (0.47) HSD17B1HSD17B2ARESRRAALOX5
SCHEMBL8921521 0.79 NR1H2 (0.48) ARFFAR1FFAR4NR1H2NR1H3

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
CN-1080251-C Dihalopropene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient and intermediate compound for use inproduct of said dihalopropene compounds SUMITOMO CHEMICAL CO (JP) 2002-03-06 — — CN disclosed
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
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
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