SCHEMBL8553238

SCHEMBL8553238

N#Cc1n[nH]c(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c1C(=O)C1CCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.33
FASN P49327 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
GABRP O00591 1/20 0.32
GABRD O14764 1/20 0.32
NR1I2 O75469 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB1 P18505 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
GABRB2 P47870 1/20 0.32
GABRA4 P48169 1/20 0.32
GABRE P78334 1/20 0.32
GABRA6 Q16445 1/20 0.32
GABRG1 Q8N1C3 1/20 0.32

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
SCHEMBL8397807 0.82 SMN1; SMN2 (0.35) ARFASNSMN1; SMN2GABRPGABRD
SCHEMBL8401038 0.82 SMN1; SMN2 (0.35) SMN1; SMN2GABRPGABRDNR1I2LMNA
SCHEMBL8398602 0.80 SMN1; SMN2 (0.37) ARSMN1; SMN2GABRPGABRDNR1I2
SCHEMBL8556302 0.79 KMT2A (0.34) SMN1; SMN2GABRPGABRDNR1I2LMNA
SCHEMBL8554269 0.78 GABRP (0.34) SMN1; SMN2GABRPGABRDNR1I2LMNA
SCHEMBL8554009 0.78 GABRP (0.34) SMN1; SMN2GABRPGABRDNR1I2LMNA
SCHEMBL7970750 0.77 GABRP (0.33) SMN1; SMN2GABRPGABRDNR1I2LMNA
SCHEMBL8554142 0.76 SHMT1 (0.32) ARSMN1; SMN2GABRPGABRDNR1I2
SCHEMBL8401036 0.75 GABRP (0.37) SMN1; SMN2GABRPGABRDNR1I2LMNA
SCHEMBL8554505 0.73 GABRP (0.36) SMN1; SMN2GABRPGABRDNR1I2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0918756-A1 PARASITICIDAL PYRAZOLES Pfizer Limited (GB) 1999-06-02 EP disclosed
WO-1998004530-A1 PARASITICIDAL PYRAZOLES PFIZER LIMITED (GB) 1998-02-05 WO disclosed