SCHEMBL10824969

SCHEMBL10824969

C=CC(CCCCCCCCCCCC)C(=S)OC

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.40
LMNA P02545 1/20 0.35
ABCB1 P08183 1/20 0.35
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
SMPD1 P17405 3/20 0.33
TRPA1 O75762 1/20 0.33
DDAH1 O94760 1/20 0.33
GAPDH P04406 1/20 0.33
MAPT P10636 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
TSHR P16473 1/20 0.33
PLA2G2C Q5R387 1/20 0.33
GPR84 Q9NQS5 2/20 0.32
FDPS P14324 2/20 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
SCHEMBL6664280 0.79 LMNA (0.39) LMNAADH1BADH1CADH1AADH4
SCHEMBL11335992 0.79 ZDHHC7 (0.56) ZDHHC7LMNAABCB1MAPTZDHHC20
SCHEMBL4963285 0.79 ZDHHC7 (0.56) ZDHHC7LMNAABCB1MAPTZDHHC20
SCHEMBL8069085 0.79 ZDHHC7 (0.56) ZDHHC7LMNAABCB1MAPTZDHHC20
Methane SCHEMBL9752104 0.78 GPR84 (0.38) LMNAMAPTZDHHC20ZDHHC2TSHR
Methane SCHEMBL10824971 0.78 GPR84 (0.38) LMNAMAPTZDHHC20ZDHHC2TSHR
SCHEMBL7772601 0.77
SCHEMBL3274327 0.76 ZDHHC7 (0.53) ZDHHC7LMNAABCB1MAPTZDHHC20
SCHEMBL8856114 0.75 ZDHHC7 (0.46) ZDHHC7LMNASMPD1MAPTGPR84
SCHEMBL9099916 0.75 ZDHHC7 (0.46) ZDHHC7LMNASMPD1MAPTGPR84

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
JP-61163832-A None JP disclosed
JP-S61163832-A MANUFACTURE OF TRANSPARENT, HEAT-RESISTANT, HEAT-SHRINKABLE TUBE HITACHI CABLE LTD 1986-07-24 JP disclosed