SCHEMBL7097984

SCHEMBL7097984

Clc1ccc(CCCC2CCCC2)cc1Cl

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.49
ALOX15 P16050 1/20 0.49
PNMT P11086 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
SIGMAR1 Q99720 13/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
OPRK1 P41145 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
TSHR P16473 1/20 0.47
CYP2C19 P33261 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
CEL P19835 1/20 0.44

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
SCHEMBL2652238 0.89 PNMT (0.50) PNMTTAAR1SIGMAR1ALDH1A1MAPT
SCHEMBL11401683 0.85 PRMT5 (0.58) IGF1RALOX15PNMTTAAR1SIGMAR1
Ammonia Solution, Strong SCHEMBL6194671 0.80 PNMT (0.52) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL27629025 0.80 CEL (0.47) IGF1RALOX15TAAR1SIGMAR1ALDH1A1
SCHEMBL21788431 0.77 POLB (0.49) PNMTTAAR1SIGMAR1SMN1; SMN2SLC6A2
SCHEMBL25787111 0.77 POLB (0.49) PNMTTAAR1SIGMAR1SMN1; SMN2SLC6A2
SCHEMBL6854749 0.76 SIGMAR1 (0.56) SIGMAR1ALDH1A1MAPTSMN1; SMN2OPRK1
SCHEMBL20382689 0.74 CEL (0.48) IGF1RALOX15SIGMAR1SLC6A2SLC6A4
SCHEMBL21413972 0.73 SIGMAR1 (0.51) SIGMAR1CYP1A2CYP2D6
SCHEMBL9133788 0.72 CEL (0.50) IGF1RALOX15SIGMAR1SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003095441-A1 INHIBITORS OF HEPATITIS C VIRUS RNA-DEPENDENT RNA POLYMERASE, AND COMPOSITIONS AND TREATMENTS USING THE SAME PFIZER INC. (US) 2003-11-20 WO disclosed