SCHEMBL7436641

SCHEMBL7436641

CCC1(Cc2ccccc2)CCNC(=O)C1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.39
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 1/20 0.36
APEX1 P27695 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TACR1 P25103 1/20 0.36
SLC6A4 P31645 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
OPRM1 P35372 3/20 0.35
OPRL1 P41146 3/20 0.35
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35

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
SCHEMBL7442378 0.84 ELANE (0.41) ELANEMEN1CYP1A2POLBTSHR
SCHEMBL7432332 0.82 MAOA (0.36) ELANEMEN1KMT2ATDP1MAOA
SCHEMBL7435181 0.80 KDM4E (0.40) TSHRLMNANPSR1
SCHEMBL29346933 0.79 MAOA (0.36) MEN1KMT2ATACR1SLC6A4MAOA
SCHEMBL7436489 0.78 ELANE (0.38) ELANEMEN1APEX1KMT2ATACR1
SCHEMBL6730275 0.72 CYP1A2 (0.41) ELANEMEN1CYP1A2POLBTSHR
SCHEMBL16029497 0.71 MAOA (0.47) ELANEMEN1POLBKMT2ATDP1
SCHEMBL7436417 0.70 L3MBTL1 (0.46) ELANEMEN1POLBTSHRKMT2A
SCHEMBL18114517 0.70 MAOA (0.45) ELANEPOLBSLC6A4MAOAMAOB
SCHEMBL7498000 0.69 TSHR (0.49) MEN1TSHRKMT2ATACR1SLC6A4

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
US-6066666-A OPTIONALLY N-SUBSTITUTED 3-MONO- AND DI-SUBSTITUTED 2-PYRROLIDINONES AND THIOLACTAM ANALOGS; TREAT SEIZURES, ANXIETY, AND ENHANCING 4-AMINOBUTYRIC ACID (GABA)-INDUCED CHLORIDE CURRENTS AT GABA RECEPTOR/IONOPHORE COMPLEX WASHINGTON UNIVERSITY (US) 2000-05-23 US disclosed
US-5776959-A Anticonvulsant and anxiolytic lactam and thiolactam derivatives WASHINGTON UNIVERSITY (US) 1998-07-07 US disclosed