SCHEMBL7753345

SCHEMBL7753345

CCOC(=O)CC1CCN(c2ccc(C#N)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP14 P54578 3/20 0.52
SIGMAR1 Q99720 1/20 0.45
CHRNA10 Q9GZZ6 1/20 0.45
CHRNA9 Q9UGM1 1/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 2/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
MAPK1 P28482 1/20 0.45
CASP3 P42574 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CHRM4 P08173 2/20 0.44
CTSS P25774 1/20 0.43
CTSK P43235 1/20 0.43

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
SCHEMBL9416137 0.91 USP14 (0.48) USP14SIGMAR1MAPTALDH1A1CHRM4
SCHEMBL23551424 0.83 ALDH1A1 (0.47) USP14MAPTALDH1A1MEN1MAPK1
SCHEMBL132391 0.83 LGMN (0.48) MAPTALDH1A1KMT2AKDM4ELMNA
SCHEMBL22657728 0.83 ATM (0.51) MAPTALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL180951 0.82 GPR119 (0.48) MAPTALDH1A1MEN1NPC1MAPK1
SCHEMBL2654128 0.82 MAPT (0.64) CHRNA10CHRNA9MAPTALDH1A1MEN1
SCHEMBL7753402 0.81 FFAR4 (0.52) SIGMAR1CHRNA10CHRNA9CHRM4CTSS
SCHEMBL9170067 0.81 SIGMAR1 (0.59) SIGMAR1MEN1CHRM4CTSSCTSK
SCHEMBL14511126 0.81 HRH3 (0.46) MAPTALDH1A1MEN1NPC1RAB9A
SCHEMBL6794440 0.81 F10 (0.47) MAPTKDM4ELMNAGAA

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
CN-1076345-C 2,3-diaminopropionic acid derivative SUMITOMO PHARMA (JP) 2001-12-19 CN disclosed
EP-0725059-B1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMA (JP) 2001-01-17 EP disclosed
US-6048854-A ANTICOAGULANTS; ANTICANCER AGENT; WOUND HEALING AGENTS;BONE DISORDERS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-04-11 US disclosed
US-5707994-A USEFUL AS A PLATELET AGGREGATION INHIBITOR, CANCER METASTASIS INHIBITOR, WOUND HEALING AGENT OR A BONE RESORPTION INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-01-13 US disclosed
CN-1138322-A 2,3-diaminopropionic acid derivative SUMITOMO PHARMA (JP) 1996-12-18 CN disclosed
EP-0725059-A1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-08-07 EP disclosed