SCHEMBL27444507

SCHEMBL27444507

CCOC(=O)N1CCN(C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.73
▸ TDP1 Q9NUW8 2/20 0.73
▸ ABL1 P00519 1/20 0.73
▸ POLB P06746 1/20 0.73
▸ RIN1 Q13671 1/20 0.73
▸ ALDH1A1 P00352 6/20 0.64
▸ RAB9A P51151 3/20 0.64
▸ NPC1 O15118 2/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.64
▸ KDM4E B2RXH2 4/20 0.59
▸ HPGD P15428 3/20 0.59
▸ GAA P10253 3/20 0.59
▸ ATM Q13315 2/20 0.59
▸ HSD17B10 Q99714 2/20 0.59
▸ CASP1 P29466 1/20 0.59
▸ MAPK1 P28482 3/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ HTT P42858 2/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ KMT2A Q03164 1/20 0.54

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
SCHEMBL32660726 0.92 ALDH1A1 (0.70) MAPTTDP1ABL1POLBRIN1
SCHEMBL27463994 0.85 POLB (0.69) MAPTTDP1POLBALDH1A1RAB9A
SCHEMBL27542336 0.85 MAPK1 (0.55) MAPTTDP1ABL1POLBRIN1
SCHEMBL8556151 0.81 MAPT (0.64) MAPTALDH1A1SMN1; SMN2KDM4EHPGD
SCHEMBL23460483 0.80 MAPK1 (0.60) MAPTTDP1ABL1POLBRIN1
SCHEMBL1066328 0.80 RAB9A (0.78) MAPTTDP1ABL1POLBRIN1
SCHEMBL19970869 0.79 MAPT (0.69) MAPTTDP1ABL1POLBRIN1
SCHEMBL27442353 0.79 MAPT (1.00) MAPTTDP1ABL1POLBRIN1
SCHEMBL19182181 0.78 RAB9A (1.00) MAPTTDP1ABL1POLBRIN1
SCHEMBL4036336 0.78 KMT2A (0.47) MAPTPOLBALDH1A1SMN1; SMN2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1136191-C Carboxy substituted carboxamide derivatives as tachykinin receptor antagonists ������ҩ�����޹�˾ 2004-01-28 — — CN disclosed
CN-1301253-A Carboxy substituted carboxamide derivatives as tachykinin receptor antagonists AVENTIS PHARMACEUTICAL INC (US) 2001-06-27 — — CN disclosed
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