SCHEMBL31344110

SCHEMBL31344110

O=C(O)c1cc(C(F)(F)F)cnc1Oc1ccc(OC(F)(F)F)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
KMT2A Q03164 2/20 0.46
MRGPRX4 Q96LA9 2/20 0.46
MEN1 O00255 1/20 0.46
TTR P02766 1/20 0.46
PPOX P50336 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
LMNA P02545 1/20 0.46
LIPE Q05469 1/20 0.45
ATM Q13315 1/20 0.44
FFAR1 O14842 3/20 0.44
SORT1 Q99523 1/20 0.43
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 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
SCHEMBL23356328 1.00 SMN1; SMN2 (0.48) SMN1; SMN2KMT2AMRGPRX4MEN1TTR
SCHEMBL23356302 0.86 KMT2A (0.47) SMN1; SMN2KMT2AMRGPRX4LMNALIPE
SCHEMBL23356251 0.85 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1LMNALIPE
SCHEMBL31344059 0.85 SMN1; SMN2 (0.52) SMN1; SMN2KMT2AMEN1LMNALIPE
SCHEMBL23356327 0.83 KMT2A (0.53) SMN1; SMN2KMT2AATM
SCHEMBL29737621 0.83 KMT2A (0.53) SMN1; SMN2KMT2AATM
SCHEMBL23356260 0.82 KMT2A (0.51) SMN1; SMN2KMT2AATM
SCHEMBL23356277 0.82 KMT2A (0.51) SMN1; SMN2KMT2AATM
SCHEMBL23356237 0.82 KMT2A (0.51) SMN1; SMN2KMT2AATM
SCHEMBL23356257 0.82 KMT2A (0.51) SMN1; SMN2KMT2AATM

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
CN-112689633-B For inhibiting Nav1.8 Pyridinecarboxamide Compounds 利伯研究所公司 2025-01-24 CN disclosed