SCHEMBL1982000

SCHEMBL1982000

Fc1ccccc1-c1ccc(Cl)[c]c1Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PTPRC P08575 1/20 0.34
PTPN1 P18031 1/20 0.34
HSD11B1 P28845 1/20 0.34
KCNN4 O15554 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB1 P18505 1/20 0.33
GABRG2 P18507 1/20 0.33
GABRB3 P28472 1/20 0.33
GABRA5 P31644 1/20 0.33
GABRA3 P34903 1/20 0.33
GABRA2 P47869 1/20 0.33
GABRB2 P47870 1/20 0.33
GABRA4 P48169 1/20 0.33
GABRE P78334 1/20 0.33
GABRA6 Q16445 1/20 0.33
GABRG1 Q8N1C3 1/20 0.33

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
SCHEMBL10475010 0.84 PTPRC (0.34) KDM4EALDH1A1PTPRCPTPN1HSD11B1
SCHEMBL15636867 0.80 CA1 (0.32) NPC1RAB9A
SCHEMBL15637369 0.79 CYP2A6 (0.43) KDM4EALDH1A1PTPRCHSD11B1NOTUM
SCHEMBL17514849 0.78 KMO (0.36) HSD11B1
SCHEMBL9728771 0.76 TAAR1 (0.34) SMN1; SMN2
SCHEMBL432734 0.73 PTPRC (0.35) KDM4EALDH1A1PTPRCPTPN1HSD11B1
SCHEMBL456350 0.72 CYP2A6 (0.44) KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL29547174 0.72 ACHE (0.47) KDM4EALDH1A1PTPRCPTPN1NOTUM
SCHEMBL197834 0.72 ACHE (0.47) KDM4EALDH1A1PTPRCPTPN1NOTUM
SCHEMBL3873200 0.72 NOTUM (0.37) NOTUMIDO1

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-2011072207-A1 AZOCYCLIC INHIBITORS OF FATTY ACID AMIDE HYDROLASE E. I. DU PONT DE NEMOURS AND COMPANY (US) 2011-06-16 WO disclosed