SCHEMBL9870039

SCHEMBL9870039

FC(F)(F)c1ccccc1-c1c[nH]c(CCl)n1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.40
SCN9A Q15858 2/20 0.39
CTSK P43235 1/20 0.39
TRPA1 O75762 6/20 0.38
TRPM8 Q7Z2W7 3/20 0.38
TRPV1 Q8NER1 2/20 0.38
ACP1 P24666 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
HSD11B1 P28845 1/20 0.37
TLR8 Q9NR97 1/20 0.37
C1R P00736 1/20 0.37
CYP2D6 P10635 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.36
NOTUM Q6P988 1/20 0.36

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
SCHEMBL16481863 0.76 HSD11B1 (0.47) KMOCTSKTRPA1TRPM8TRPV1
SCHEMBL8744737 0.73 CTSK (0.47) KMOSCN9ACTSKTRPA1TRPM8
SCHEMBL12066524 0.73 PDE10A (0.67) C1R
SCHEMBL259080 0.72 KDM4E (0.42) CYP1A2CYP3A4
SCHEMBL21058751 0.70 ACP1 (0.47) KMOSCN9ACTSKTRPA1TRPM8
SCHEMBL20764969 0.70 HSD11B1 (0.47) KMOCTSKTRPA1TRPM8TRPV1
SCHEMBL30514768 0.70 HSD11B1 (0.47) KMOCTSKTRPA1TRPM8TRPV1
SCHEMBL4592066 0.69 HSD11B1 (0.43) KMOCTSKTRPA1TRPM8TRPV1
SCHEMBL4291142 0.68 HSP90AA1 (0.64) CTSKACP1
SCHEMBL21690275 0.66 HSD11B1 (0.46) KMOACP1CYP1A2CYP3A4HSD11B1

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
US-4996204-A Antidiabetic agents PFIZER INC. (US) 1991-02-26 US disclosed