SCHEMBL8364830

SCHEMBL8364830

O=C(O)c1cc(-c2ccc(Cl)cc2)n(Cc2ccc(Cl)cc2Cl)n1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MARS1 P56192 8/20 0.69
▸ SLC16A3 O15427 2/20 0.64
▸ SLC16A1 P53985 2/20 0.64
▸ MCTS1 Q9ULC4 2/20 0.64
▸ RPA1 P27694 3/20 0.60
▸ MALT1 Q9UDY8 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ PTGER1 P34995 1/20 0.54
▸ PPP1CA P62136 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.52
▸ NPC1 O15118 1/20 0.52

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
Hydrochloric Acid SCHEMBL8368102 0.99 MARS1 (0.67) MARS1SLC16A3SLC16A1MCTS1RPA1
SCHEMBL8366696 0.93 MARS1 (0.64) MARS1SLC16A3SLC16A1MCTS1RPA1
SCHEMBL8368101 0.90 SLC16A3 (0.60) MARS1SLC16A3SLC16A1MCTS1RPA1
SCHEMBL8369104 0.90 MARS1 (0.64) MARS1SLC16A3SLC16A1MCTS1RPA1
SCHEMBL8366394 0.90 MARS1 (0.60) MARS1SLC16A3SLC16A1MCTS1RPA1
SCHEMBL8366446 0.89 MARS1 (0.69) MARS1SLC16A3SLC16A1MCTS1RPA1
SCHEMBL8368131 0.88 MARS1 (0.58) MARS1SLC16A3SLC16A1MCTS1RPA1
SCHEMBL8369870 0.85 SLC16A3 (0.62) MARS1SLC16A3SLC16A1MCTS1MALT1
SCHEMBL17727586 0.83 NPC1 (0.69) MARS1SMN1; SMN2PTGER1NPC1
SCHEMBL28554732 0.82 MARS1 (0.61) MARS1SLC16A3SLC16A1MCTS1RPA1

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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