SCHEMBL8591058

SCHEMBL8591058

O=C(O)c1cc(-c2ccc3ccccc3c2)n(-c2ccccc2)n1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RPA1 P27694 5/20 0.73
▸ PPP1CA P62136 4/20 0.69
▸ L3MBTL1 Q9Y468 1/20 0.68
▸ MDM2 Q00987 6/20 0.63
▸ MCL1 Q07820 5/20 0.63
▸ BCL2 P10415 4/20 0.63
▸ MEN1 O00255 1/20 0.60
▸ KMT2A Q03164 1/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ MARS1 P56192 1/20 0.58

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
SCHEMBL8590028 0.89 PPP1CA (0.59) RPA1PPP1CAL3MBTL1MDM2MCL1
SCHEMBL695352 0.85 RPA1 (1.00) RPA1PPP1CAL3MBTL1MDM2MCL1
SCHEMBL6457030 0.83 MARS1 (0.62) RPA1PPP1CAL3MBTL1MDM2MCL1
SCHEMBL4500796 0.81 L3MBTL1 (1.00) RPA1PPP1CAL3MBTL1MDM2MCL1
SCHEMBL27714729 0.81 KMT2A (0.89) RPA1PPP1CAL3MBTL1MDM2MCL1
SCHEMBL1987609 0.79 RPA1 (0.82) RPA1PPP1CAL3MBTL1MDM2MCL1
SCHEMBL24157617 0.78 CYP2C9 (0.49) RPA1MCL1MEN1KMT2ASMN1; SMN2
SCHEMBL27882807 0.78 RAB9A (0.71) L3MBTL1SMN1; SMN2
SCHEMBL8591001 0.77 CACNA1G (0.55) RPA1PPP1CAMDM2MCL1BCL2
SCHEMBL8591003 0.77 CACNA1G (0.55) RPA1PPP1CAMDM2MCL1BCL2

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5744493-A POSSESS ACTIVITY WITH RESPECT TO THE CENTRAL NERVOUS SYSTEM, THE CARDIOVASCULAR SYSTEM AND THE GASTROINTESTINAL SYSTEM SANOFI (FR) 1998-04-28 — — US disclosed
US-5744491-A POSSESS ACTIVITY WITH RESPECT TO THE CENTRAL NERVOUS SYSTEM, THE CARDIOVASCULAR SYSTEM AND THE GASTROINTESTINAL SYSTEM SANOFI (FR) 1998-04-28 — — US disclosed
US-5635526-A POSSESSES ACTIVITY WITH RESPECT TO THE CENTRAL NERVOUS SYSTEM, THE CARDIOVASCULAR SYSTEM OR THE GASTROINTESTINAL SYSTEM SANOFI (FR) 1997-06-03 — — US disclosed
US-5616592-A USEFUL FOR DISORDERS OF CARDIOVASCULAR, GASTROINTESTINAL AND PSYCHOLOGICAL DISORDERS SANOFI (FR) 1997-04-01 — — US disclosed
US-5607958-A NEUROTENSIN RECEPTOR BINDERS SANOFI (FR) 1997-03-04 — — US disclosed
US-5420141-A Capable of binding to neurotensin receptor SANOFI (FR) 1995-05-30 — — US disclosed
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