SCHEMBL3988299

SCHEMBL3988299

CC(C)=COC(=O)C1CC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.33
TP53 P04637 1/20 0.31
KMT2A Q03164 2/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL11115869 0.82 KMT2A (0.32) TRPA1KMT2A
SCHEMBL10363108 0.76 KMT2A (0.30) KMT2AHTTSMN1; SMN2TDP1
SCHEMBL11227867 0.76 KMT2A (0.30) KMT2AHTTSMN1; SMN2TDP1
SCHEMBL11642455 0.76 KMT2A (0.30) KMT2AHTTSMN1; SMN2TDP1
SCHEMBL6076974 0.75
SCHEMBL9421500 0.73 KMT2A (0.36) TRPA1TP53KMT2ATDP1
Acetic Acid SCHEMBL585034 0.73 KMT2A (0.36) KMT2A
SCHEMBL6939540 0.72 ELANE (0.34) KMT2AHTTSMN1; SMN2TDP1
SCHEMBL11239979 0.72
SCHEMBL9810358 0.71

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
EP-2061789-A2 THIADIAZOLE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2009-05-27 EP disclosed
CN-100417324-C Compsn. of agricultural pesticide and preparation method UNIV BEIJING CHEMICAL (CN) 2008-09-10 CN disclosed
WO-2008032858-A2 THIADIAZOLE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-03-20 WO disclosed
WO-2006095888-A2 PROCESS FOR PRODUCING A MIXTURE OF PARTICLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-09-14 WO disclosed
CN-1695446-A Compsn. of agricultural pesticide and preparation method UNIV BEIJING CHEMICAL (CN) 2005-11-16 CN disclosed
US-4691052-A Process for the preparation of pyrethroid acids S.C. JOHNSON & SON, INC. (US) 1987-09-01 US disclosed