SCHEMBL9074707

SCHEMBL9074707

C=C(C)C(=O)OC(Br)(Br)c1cccs1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.34
KMT2A Q03164 3/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
NLRP1 Q9C000 1/20 0.34
MAPT P10636 4/20 0.33
NPSR1 Q6W5P4 1/20 0.33
ELANE P08246 1/20 0.33
ALDH1A1 P00352 4/20 0.33
HSD17B10 Q99714 1/20 0.33
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
CHRM3 P20309 8/20 0.32
CHRM2 P08172 6/20 0.32
CHRM1 P11229 4/20 0.32
PKM P14618 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL20887795 0.79 RIPK1 (0.36) KMT2AHPGDMAPTALDH1A1HSD17B10
SCHEMBL14827362 0.76 SMN1; SMN2 (0.41) KMT2AHPGDMAPTALDH1A1HSD17B10
SCHEMBL14828484 0.76 SRPK1 (0.35) KMT2AMAPTCES2CES1GAA
SCHEMBL14827337 0.75 MAPT (0.33) KMT2AHTTMAPTCHRM3PKM
SCHEMBL14825625 0.74 CHRM3 (0.33) KMT2AMAPTALDH1A1CHRM3CHRM2
SCHEMBL1153548 0.73 ELANE (0.44) KMT2AHPGDMAPTELANEALDH1A1
SCHEMBL2464311 0.69 MMP1 (0.44) LMNAKMT2AHPGDHTTNLRP1
SCHEMBL11163984 0.69 ELANE (0.37) LMNAKMT2AHTTELANEALDH1A1
SCHEMBL709529 0.68 ALDH1A1 (0.31) KMT2AELANEALDH1A1ATM
Methylamine SCHEMBL4298188 0.67 MMP1 (0.42) LMNAKMT2AHPGDHTTNLRP1

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-0273710-B2 Resin having high refractive index, process for producing said resin and optical materials composed of said resin NIPPON CATALYTIC CHEM IND (JP) 1996-10-16 EP disclosed
US-4931521-A Optical materials composed of resin from thioacrylat esters NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1990-06-05 US disclosed