SCHEMBL31575643

SCHEMBL31575643

NC(=O)c1ccc(C(F)F)nc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
KDM4E B2RXH2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGDS O60760 1/20 0.44
GRM5 P41594 1/20 0.42
F7 P08709 1/20 0.41
F3 P13726 1/20 0.41
SARM1 Q6SZW1 1/20 0.41
SIRT2 Q8IXJ6 1/20 0.41
SIRT6 Q8N6T7 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
SIRT3 Q9NTG7 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
SIRT4 Q9Y6E7 1/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
GABRA5 P31644 2/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37

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
SCHEMBL25338791 1.00 NNMT (0.55) NNMTSMN1; SMN2KDM4EL3MBTL1HPGDS
SCHEMBL22436933 0.82 P4HA1 (0.55) L3MBTL1GABRA5GABRPGABRDGABRA1
SCHEMBL29859790 0.81 KCNJ1 (0.42) SMN1; SMN2L3MBTL1
Hydrochloric Acid SCHEMBL22612522 0.81 P4HA1 (0.53) L3MBTL1GABRA5GABRPGABRDGABRA1
SCHEMBL17823689 0.81 KCNJ1 (0.42) SMN1; SMN2L3MBTL1
SCHEMBL31517714 0.81 NNMT (0.55) NNMTSMN1; SMN2KDM4EL3MBTL1HPGDS
SCHEMBL30936066 0.81 UBE2T (0.45)
SCHEMBL531287 0.81 NNMT (0.55) NNMTSMN1; SMN2KDM4EL3MBTL1HPGDS
SCHEMBL28772115 0.79 NNMT (0.53) NNMTSMN1; SMN2KDM4EL3MBTL1HPGDS
SCHEMBL20075627 0.78 KDM4E (0.42) KDM4E

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-120019049-A Azole modulators of cholesterol biosynthesis and their use for promoting remyelination 基因泰克公司 2025-05-16 CN disclosed