SCHEMBL11041362

SCHEMBL11041362

C=CCCCCCC(CCCC)OC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.49
ALDH1A1 P00352 3/20 0.49
CYP3A4 P08684 2/20 0.49
MAPT P10636 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 2/20 0.47
LMNA P02545 2/20 0.43
RECQL P46063 1/20 0.43
GLS2 Q9UI32 3/20 0.42
PLA2G2C Q5R387 1/20 0.42
PRKCA P17252 2/20 0.40

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
SCHEMBL30722293 0.97 TSHR (0.52) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL11121672 0.94 USP2 (0.49) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL11124230 0.94 USP2 (0.49) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL4016772 0.93 USP2 (0.54) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL16265047 0.92 TSHR (0.44) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL4479940 0.90 PLA2G2C (0.48) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL833125 0.90 PLA2G2C (0.48) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
Acetic Acid SCHEMBL28958215 0.88 TSHR (0.46) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL11122986 0.87 ALDH1A1 (0.41) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2
SCHEMBL6432724 0.86 TRPV1 (0.48) USP2ALDH1A1CYP3A4MAPTSMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0038052-B1 METHOD FOR THE PREPARATION OF CIS-ALKENYL BROMIDE AND ACETATE Shin-Etsu Chemical Co., Ltd. (JP) 1984-03-07 EP disclosed
EP-0038052-A1 Method for the preparation of cis-alkenyl bromide and acetate Shin-Etsu Chemical Co., Ltd. (JP) 1981-10-21 EP disclosed