SCHEMBL8566845

SCHEMBL8566845

Cc1c(CC(=O)N(C)C)cccc1-c1ccccc1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 6/20 0.53
▸ PDCD1 Q15116 1/20 0.53
▸ PTGS1 P23219 1/20 0.46
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NR4A2 P43354 2/20 0.41
▸ LTB4R Q15722 2/20 0.40
▸ LTB4R2 Q9NPC1 2/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ EPHX1 P07099 1/20 0.39
▸ FOLH1 Q04609 1/20 0.39

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
SCHEMBL8720333 0.84 KMT2A (0.51) CD274PDCD1KMT2AMEN1SMN1; SMN2
SCHEMBL8567776 0.84 KMT2A (0.43) CD274PDCD1KMT2AMEN1SMN1; SMN2
SCHEMBL8570065 0.81 POLQ (0.45) CD274PDCD1KMT2AMEN1SMN1; SMN2
SCHEMBL9890713 0.76 FFAR1 (0.42) NR4A2ALDH1A1
SCHEMBL8565707 0.76 POLQ (0.52) CD274PDCD1KMT2AMEN1SMN1; SMN2
SCHEMBL8566848 0.75 TACR1 (0.53) CD274PDCD1PTGS1KMT2AMEN1
SCHEMBL8572406 0.73 POLQ (0.53) ALDH1A1
SCHEMBL9890715 0.73 CYP2C19 (0.49) KMT2AMEN1NR4A2LTB4R2SLC6A4
SCHEMBL9890721 0.73 MLNR (0.47) KMT2AMEN1LTB4R2SLC6A4SLC6A3
SCHEMBL9890717 0.72 CHRM1 (0.65) NR4A2

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
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 — — US disclosed
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