SCHEMBL7273963

SCHEMBL7273963

CN(C(=O)CCl)C(C)(Cc1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ CYP3A4 P08684 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ CYP2C19 P33261 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ SCN1A P35498 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ SCN2A Q99250 1/20 0.46
▸ SCN3A Q9NY46 1/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ RAB9A P51151 8/20 0.45
▸ NPC1 O15118 7/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ MAPK1 P28482 1/20 0.44
▸ ALDH1A1 P00352 5/20 0.44
▸ HTT P42858 4/20 0.44

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
SCHEMBL7266022 0.84 CYP1A2 (0.56) KMT2AMEN1CYP3A4LMNACYP2C19
SCHEMBL9234745 0.84 KMT2A (0.62) KMT2AMEN1CYP3A4LMNACYP2C19
Hydrochloric Acid SCHEMBL9678356 0.81 MAPK1 (0.48) KMT2AMEN1CYP3A4LMNACYP2C19
Fumaric Acid SCHEMBL7267252 0.79 CYP3A4 (0.50) KMT2AMEN1CYP3A4LMNACYP2C19
Maleic Acid SCHEMBL7267250 0.79 CYP3A4 (0.50) KMT2AMEN1CYP3A4LMNACYP2C19
Hydrochloric Acid SCHEMBL9511381 0.76 MAPK1 (0.56) KMT2AMEN1CYP3A4LMNACYP2C19
SCHEMBL27661323 0.74 TAAR1 (0.50) KMT2AMEN1CYP3A4LMNACYP2C19
SCHEMBL9776961 0.74 CHRM1 (0.44) KMT2AMEN1CYP3A4LMNACYP2C19
Hydrochloric Acid SCHEMBL9172426 0.71 MAPK1 (0.47) KMT2AMEN1CYP3A4LMNACYP2C19
SCHEMBL8733650 0.70 ESR2 (0.47) KMT2AMEN1LMNACYP2C19HIF1A

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-5605916-A Arylalkyl-amines having anticonvulsant and neuroprotective properties ASTRA AB (SE) 1997-02-25 — — US disclosed
US-5539120-A Arylalkyl-amines having anticonvulsant and neuroprotective properties AGENCE SPATIALE EUROPEENNE (FR) 1996-07-23 — — US disclosed
US-5430044-A Arylalkyl-amines and -amides having anticonvulsant and neuroprotective properties FISONS CORPORATION (GB) 1995-07-04 — — US disclosed
US-5331007-A Arylalkyl-amines and -amides having anticonvulsant and neuroprotective properties FISONS CORPORATION (US) 1994-07-19 — — US disclosed
EP-0279937-B1 2-AMINOACETAMIDE DERIVATIVES FISONS CORPORATION (US) 1991-10-09 — — EP disclosed
EP-0279937-A1 2-Aminoacetamide derivatives FISONS CORPORATION (US) 1988-08-31 — — EP disclosed
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