SCHEMBL11325658

SCHEMBL11325658

C=CCCCCCCS(=O)(=O)CCCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.60
ALDH1A1 P00352 2/20 0.52
CA2 P00918 1/20 0.45
FAAH O00519 5/20 0.40
NPC1 O15118 1/20 0.39
S1PR2 O95136 1/20 0.39
S1PR4 O95977 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
XBP1 P17861 1/20 0.39
S1PR1 P21453 1/20 0.39
MAPK1 P28482 1/20 0.39
AGTR1 P30556 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 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
SCHEMBL11333906 0.96 TSHR (0.67) TSHRALDH1A1CA2FAAHCES1
SCHEMBL11338025 0.96 TSHR (0.67) TSHRALDH1A1CA2FAAHCES1
SCHEMBL11337949 0.96 TSHR (0.67) TSHRALDH1A1CA2FAAHCES1
SCHEMBL11340065 0.92 TSHR (0.60) TSHRALDH1A1CA2FAAHCES1
SCHEMBL11328103 0.89 TSHR (0.50) TSHRALDH1A1CA2FAAHLMNA
SCHEMBL19644547 0.89 TSHR (0.46) TSHRALDH1A1CA2LMNAMAPT
SCHEMBL20972793 0.89 TSHR (0.46) TSHRALDH1A1CA2LMNAMAPT
SCHEMBL11323118 0.87 TSHR (0.42) TSHRALDH1A1CA2LMNAMAPT
SCHEMBL14478063 0.82 CA2 (0.61) ALDH1A1CA2FAAHNPC1S1PR2
SCHEMBL5956866 0.80 TSHR (0.61) TSHRALDH1A1FAAH

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
US-4260552-A INSECTICIDES, HERBICIDES UNIROYAL, INC. (US) 1981-04-07 US disclosed
US-4160846-A Method for controlling insects with tetrasubstituted organotin compounds UNIROYAL, INC. (US) 1979-07-10 US disclosed