SCHEMBL28601911

SCHEMBL28601911

O=C(NCCc1ccc(Cl)cc1)c1ccc(-c2ccccc2)cn1

nearest known ligand 0.85

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.85
EGLN1 Q9GZT9 1/20 0.64
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62
CNR1 P21554 1/20 0.60
SCN2A Q99250 1/20 0.59
SCN10A Q9Y5Y9 1/20 0.59
MAPT P10636 4/20 0.57
LMNA P02545 1/20 0.56
GCGR P47871 1/20 0.54
MCHR1 Q99705 1/20 0.54
FAAH O00519 1/20 0.54
ADAMTS5 Q9UNA0 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL28344799 0.92 HIF1A (1.00) HIF1AEGLN1NPC1RAB9AMAPT
SCHEMBL28608835 0.90 HIF1A (0.85) HIF1AEGLN1NPC1RAB9AFAAH
SCHEMBL28596560 0.89 HIF1A (0.83) HIF1AEGLN1NPC1RAB9ACNR1
SCHEMBL28601903 0.89 HIF1A (0.83) HIF1ANPC1RAB9AGCGRMCHR1
SCHEMBL28347634 0.89 HIF1A (1.00) HIF1AEGLN1NPC1RAB9AFAAH
SCHEMBL28607757 0.87 HIF1A (1.00) HIF1AEGLN1NPC1RAB9AFAAH
SCHEMBL28601917 0.86 HIF1A (1.00) HIF1AEGLN1NPC1RAB9AMAPT
SCHEMBL7703654 0.85 HIF1A (0.72) HIF1ANPC1RAB9A
SCHEMBL28344792 0.84 HIF1A (0.76) HIF1ANPC1RAB9AMAPTLMNA
SCHEMBL28598668 0.83 HIF1A (1.00) HIF1AEGLN1

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