SCHEMBL8367178

SCHEMBL8367178

CCCNC(=O)c1cc(-c2ccc(C)cc2)n(Cc2ccc(Cl)c(Cl)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ MALT1 Q9UDY8 4/20 0.49
▸ HDAC3 O15379 2/20 0.49
▸ HDAC4 P56524 2/20 0.49
▸ HDAC1 Q13547 2/20 0.49
▸ HDAC7 Q8WUI4 2/20 0.49
▸ HDAC2 Q92769 2/20 0.49
▸ HDAC10 Q969S8 2/20 0.49
▸ HDAC11 Q96DB2 2/20 0.49
▸ HDAC8 Q9BY41 2/20 0.49
▸ HDAC6 Q9UBN7 2/20 0.49
▸ HDAC9 Q9UKV0 2/20 0.49
▸ HDAC5 Q9UQL6 2/20 0.49
▸ NCOR2 Q9Y618 2/20 0.49
▸ CNR2 P34972 4/20 0.47
▸ CNR1 P21554 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ TP53 P04637 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL8368039 0.90 NPC1 (0.51) NPC1RAB9AMALT1CNR2CNR1
SCHEMBL8046115 0.83 RPA1 (0.63) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8369218 0.83 RPA1 (0.51) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8368094 0.83 HDAC3 (0.50) RAB9AMALT1HDAC3HDAC4HDAC1
SCHEMBL8366452 0.82 RPA1 (0.50) MALT1HDAC3HDAC4HDAC1HDAC7
Hydrochloric Acid SCHEMBL8369220 0.82 RPA1 (0.62) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8369101 0.78 RPA1 (0.61) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8366637 0.77 HDAC3 (0.42) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8369875 0.76 MARS1 (0.56) MALT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8369821 0.75 HDAC3 (0.49) RAB9AMALT1HDAC3HDAC4HDAC1

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-5925768-A ANTIINFLAMMATORY AGENTS; ANALGESICS, ANTICOAGULANTS, NARCOTICS SANOFI (FR) 1999-07-20 — — US disclosed
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