SCHEMBL7935274

SCHEMBL7935274

COc1cc(Oc2ncc(C(F)(F)F)cc2Cl)ccc1C=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.55
RAB9A P51151 1/20 0.54
SMN1; SMN2 Q16637 6/20 0.53
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
ALDH1A1 P00352 4/20 0.52
LIPE Q05469 1/20 0.52
HPGD P15428 3/20 0.50
HTT P42858 3/20 0.49
MAPT P10636 2/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
XBP1 P17861 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ATM Q13315 1/20 0.48
FFAR1 O14842 1/20 0.48

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
SCHEMBL7945235 0.87 RAB9A (0.55) LMNARAB9ASMN1; SMN2CYP1A2CYP3A4
SCHEMBL3204732 0.87 LMNA (0.52) LMNASMN1; SMN2CYP1A2CYP3A4CYP2C19
SCHEMBL3215665 0.86 PPARG (0.61) LMNASMN1; SMN2ALDH1A1HPGD
SCHEMBL9828236 0.85 LMNA (0.53) LMNARAB9ASMN1; SMN2ALDH1A1LIPE
SCHEMBL9572436 0.85 RAB9A (0.65) LMNARAB9ASMN1; SMN2CYP1A2CYP3A4
SCHEMBL3220986 0.82 RAB9A (0.58) LMNARAB9ASMN1; SMN2CYP1A2CYP3A4
SCHEMBL7945622 0.80 SMN1; SMN2 (0.62) LMNARAB9ASMN1; SMN2CYP1A2CYP3A4
SCHEMBL9790809 0.80 LMNA (0.67) LMNARAB9ASMN1; SMN2CYP1A2CYP3A4
SCHEMBL31694897 0.80 CYP1A2 (0.65) LMNARAB9ASMN1; SMN2CYP1A2CYP3A4
SCHEMBL11151734 0.80 LMNA (0.53) LMNARAB9ASMN1; SMN2CYP1A2CYP3A4

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
WO-2010015653-A1 PYRIMIDINE DERIVATIVES AS ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE SMITHKLINE BEECHAM CORPORATION (US) 2010-02-11 WO disclosed
WO-2009071504-A1 2,6-DISUBSTITUTED PYRIDINES AS SOLUBLE GUANYLATE CYCLASE ACTIVATORS SMITHKLINE BEECHAM CORPORATION (US) 2009-06-11 WO disclosed