SCHEMBL9303006

SCHEMBL9303006

CNC(C)(C)CCC1(c2ccccc2)CC(=O)NC(=O)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.37
CYP2D6 P10635 1/20 0.37
KCNA3 P22001 2/20 0.36
SLC6A4 P31645 2/20 0.36
BACE1 P56817 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ICMT O60725 2/20 0.33
TACR1 P25103 4/20 0.33
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
TSHR P16473 1/20 0.32
APEX1 P27695 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
TAAR1 Q96RJ0 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31

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
SCHEMBL9303403 0.77 SLC6A2 (0.43) CYP2D6SLC6A4BACE1ICMTMEN1
SCHEMBL9302750 0.75 DDB1 (0.37) LMNASLC6A4BACE1ALDH1A1TACR1
SCHEMBL9304790 0.73 TAAR1 (0.36) SLC6A4BACE1TACR1TAAR1OPRM1
SCHEMBL9467170 0.73 TSHR (0.47) LMNASLC6A4BACE1MEN1CYP1A2
Formic Acid SCHEMBL9303273 0.71 SLC6A2 (0.40) CYP2D6KCNA3SLC6A4BACE1ICMT
SCHEMBL9303673 0.70 CNR2 (0.34) TACR1TAAR1OPRM1OPRL1
SCHEMBL9304060 0.69 KDM4E (0.36) SLC6A4TACR1OPRM1OPRL1
SCHEMBL9304467 0.69 UTS2R (0.35)
SCHEMBL9304202 0.66 SIGMAR1 (0.46) MAOB
SCHEMBL9869620 0.65 SIGMAR1 (0.49) SLC6A4TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505379-B1 MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LTD (GB) 1994-07-20 EP disclosed
US-5300516-A Muscarinic receptor antagonists PFIZER INC. (US) 1994-04-05 US disclosed
WO-1991009014-A1 MUSCARINIC RECEPTOR ANTAGONISTS PFIZER LIMITED (GB) 1991-06-27 WO disclosed