SCHEMBL28608102

SCHEMBL28608102

O=C(NCCc1ccccc1F)c1ccc(-c2cn[nH]c2)cn1

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 12/20 0.76
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
ROCK2 O75116 5/20 0.47
ROCK1 Q13464 4/20 0.47
TRPV1 Q8NER1 1/20 0.45
SNCA P37840 1/20 0.44

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
SCHEMBL28598211 0.86 HIF1A (1.00) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28345384 0.85 HIF1A (0.88) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28348077 0.84 HIF1A (0.86) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28344737 0.84 HIF1A (1.00) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28348304 0.83 HIF1A (0.81) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28594259 0.83 HIF1A (0.84) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28347862 0.82 HIF1A (0.83) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28347976 0.81 HIF1A (0.84) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28345259 0.80 HIF1A (1.00) HIF1AMEN1NPC1RAB9AKMT2A
SCHEMBL28344622 0.80 HIF1A (0.79) HIF1AMEN1NPC1RAB9AKMT2A

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-110407824-B Aryl formamide compound and preparation method, pharmaceutical composition and application thereof 安徽医科大学 2021-07-02 CN disclosed