SCHEMBL9253907

SCHEMBL9253907

FCS(Cl)(Cl)c1ccc(-c2cccc(Cl)c2)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.41
NOTUM Q6P988 1/20 0.41
SCN2A Q99250 1/20 0.40
IDO1 P14902 2/20 0.40
NPY5R Q15761 1/20 0.37
DHFR P00374 1/20 0.36
GCGR P47871 1/20 0.36
MAPK14 Q16539 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
HRH1 P35367 1/20 0.35
FFAR1 O14842 1/20 0.34
PPARG P37231 1/20 0.34

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
SCHEMBL9254245 0.74 ALDH1A1 (0.42) BRD4NOTUMSCN2AIDO1NPY5R
SCHEMBL9701825 0.65 NOTUM (0.62) BRD4NOTUMSCN2AIDO1DHFR
SCHEMBL15331038 0.65 ALDH1A1 (0.57) BRD4NOTUMSCN2AIDO1NPY5R
SCHEMBL9253366 0.65 SCN2A (0.44) BRD4NOTUMSCN2AIDO1NPY5R
SCHEMBL9253902 0.64 ALDH1A1 (0.41) BRD4NOTUMSCN2AIDO1NPY5R
SCHEMBL817554 0.63 ALOX5 (0.65) NOTUMIDO1ALDH1A1TAAR1MAOB
SCHEMBL31222672 0.63 ALOX5 (0.65) NOTUMIDO1ALDH1A1TAAR1MAOB
SCHEMBL13962411 0.63 SIRT1 (0.48) BRD4NOTUMDHFRHRH1FFAR1
SCHEMBL237434 0.62 IDO1 (0.56) BRD4NOTUMSCN2AIDO1NPY5R
Hydrochloric Acid SCHEMBL31070804 0.61 ALOX5 (0.62) NOTUMIDO1ALDH1A1TAAR1MAOB

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-5378724-A Insecticide. miticide, nematocide BAYER AKTIENGESELLSCHAFT (DE) 1995-01-03 US disclosed