SCHEMBL9010973

SCHEMBL9010973

O=C(O)C(Cc1ccccc1)C1CCN(C(=O)c2ccc3ccccc3c2)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.63
NPC1 O15118 2/20 0.60
RAB9A P51151 1/20 0.60
CAPN1 P07384 2/20 0.59
CTSB P07858 1/20 0.59
TSHR P16473 2/20 0.53
LMNA P02545 2/20 0.53
HPGD P15428 1/20 0.52
AKR1C1 Q04828 1/20 0.51
L3MBTL3 Q96JM7 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CHRM2 P08172 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
USP2 O75604 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL9011157 0.90 DRD4 (0.63) DRD4NPC1RAB9ACAPN1CTSB
SCHEMBL9011267 0.86 DRD4 (0.60) DRD4NPC1RAB9ACAPN1CTSB
SCHEMBL7804403 0.85 DRD4 (0.56) DRD4NPC1RAB9ACAPN1CTSB
SCHEMBL7804396 0.83 NPC1 (0.54) DRD4NPC1RAB9ACAPN1CTSB
SCHEMBL9011146 0.81 NPC1 (0.65) DRD4NPC1RAB9ACAPN1CTSB
SCHEMBL7231605 0.80 ACHE (0.70) DRD4NPC1RAB9ACHRM2CA12
SCHEMBL9010986 0.79 AVPR1A (0.56) TSHRLMNACHRM2USP2ALDH1A1
SCHEMBL9011130 0.78 NPC1 (0.58) DRD4NPC1RAB9ACAPN1CTSB
SCHEMBL9011031 0.78 NPC1 (0.58) DRD4NPC1RAB9ACAPN1CTSB
SCHEMBL7719493 0.77 DRD4 (0.64) DRD4NPC1RAB9ACAPN1CTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1035178-C Arylamide derivatives SS PHARMACEUTICAL CO (JP) 1997-06-18 CN disclosed
US-5532371-A SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5411972-A Arylamide derivatives for treating hyperlipemia SS PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0607536-A1 Arylamide derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1994-07-27 EP disclosed