SCHEMBL8368125

SCHEMBL8368125

Cc1ccc(-c2cc(C(=O)Cl)nn2CCc2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RPA1 P27694 2/20 0.49
▸ HDAC3 O15379 2/20 0.45
▸ HDAC4 P56524 2/20 0.45
▸ HDAC1 Q13547 2/20 0.45
▸ HDAC7 Q8WUI4 2/20 0.45
▸ HDAC2 Q92769 2/20 0.45
▸ HDAC10 Q969S8 2/20 0.45
▸ HDAC11 Q96DB2 2/20 0.45
▸ HDAC8 Q9BY41 2/20 0.45
▸ HDAC6 Q9UBN7 2/20 0.45
▸ HDAC9 Q9UKV0 2/20 0.45
▸ HDAC5 Q9UQL6 2/20 0.45
▸ NCOR2 Q9Y618 2/20 0.45
▸ MARS1 P56192 2/20 0.42
▸ SMPD1 P17405 1/20 0.41
▸ CNR2 P34972 4/20 0.41
▸ PPP1CA P62136 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ SIGMAR1 Q99720 2/20 0.39
▸ NR1I3 Q14994 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
SCHEMBL8369874 0.91 RPA1 (0.61) RPA1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8369627 0.90 CNR2 (0.44) RPA1HDAC6MARS1SMPD1CNR2
SCHEMBL8369218 0.88 RPA1 (0.51) RPA1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8369248 0.87 CNR2 (0.50) RPA1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8368110 0.81 CNR2 (0.49) RPA1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8369654 0.81 MARS1 (0.49) RPA1MARS1CNR2PPP1CACNR1
SCHEMBL8046115 0.79 RPA1 (0.63) RPA1HDAC3HDAC4HDAC1HDAC7
SCHEMBL5903036 0.79 CNR2 (0.59) RPA1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8368933 0.78 RPA1 (0.51) RPA1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8366452 0.78 RPA1 (0.50) RPA1HDAC3HDAC4HDAC1HDAC7

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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