SCHEMBL8318965

SCHEMBL8318965

O=C(O)Cc1ccc(NCC(Cl)=C(Cl)Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
RAB9A P51151 1/20 0.51
GFER P55789 1/20 0.51
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
CA2 P00918 1/20 0.46
CAMK2A Q9UQM7 1/20 0.46
AKR1B1 P15121 1/20 0.44
KDM4E B2RXH2 2/20 0.43
GAA P10253 2/20 0.43
ABCC4 O15439 1/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
PTGS1 P23219 1/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.43
NR1H4 Q96RI1 3/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL13611310 0.83 FFAR1 (0.59) FFAR1SMN1; SMN2RAB9AGFERKMT2A
SCHEMBL11798378 0.76 FFAR1 (0.51) FFAR1SMN1; SMN2RAB9AGFERKMT2A
SCHEMBL11407393 0.75 FFAR1 (0.54) FFAR1SMN1; SMN2RAB9AGFERKMT2A
SCHEMBL10067955 0.74 FFAR1 (0.57) FFAR1SMN1; SMN2RAB9AGFERKMT2A
Bromide SCHEMBL11466073 0.73 FFAR1 (0.56) FFAR1SMN1; SMN2RAB9AGFERKMT2A
Phenylacetic Acid SCHEMBL28981718 0.73 AKR1B1 (0.65) FFAR1SMN1; SMN2RAB9AGFERKMT2A
SCHEMBL3841167 0.73 POLB (0.57) FFAR1SMN1; SMN2RAB9AGFERKMT2A
SCHEMBL11232512 0.72 FFAR1 (0.71) FFAR1SMN1; SMN2RAB9AGFERKMT2A
SCHEMBL69614 0.72 CA2 (0.79) FFAR1KMT2AMEN1CA2CAMK2A
SCHEMBL9516674 0.71 POLB (0.47) FFAR1SMN1; SMN2RAB9AGFERKMT2A

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-5994145-A Reagents, methods and kits for detecting trichloroethylene and perchloroethylene STRATEGIC DIAGNOSTICS INC. (US) 1999-11-30 US disclosed