SCHEMBL8665199

SCHEMBL8665199

CCCNC(=O)C1(CCCCN2CCC(OC(N)=O)C2)c2ccccc2-c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTTP P55157 2/20 0.45
CHRM2 P08172 1/20 0.45
ADRA2A P08913 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CHRM1 P11229 1/20 0.45
DRD1 P21728 1/20 0.45
TBXA2R P21731 1/20 0.45
PTGS1 P23219 1/20 0.45
SLC6A2 P23975 1/20 0.45
ADRA1A P35348 1/20 0.45
OPRM1 P35372 1/20 0.45
DRD3 P35462 1/20 0.45
SLC6A3 Q01959 1/20 0.45
KCNH2 Q12809 1/20 0.45
MTR Q99707 1/20 0.45
CHRM3 P20309 8/20 0.41

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
SCHEMBL8483884 0.95 MTTP (0.42) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL8500654 0.84 MTTP (0.41) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL8896731 0.82 MTTP (0.51) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL8896448 0.80 MTTP (0.54) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL8904893 0.80 MTTP (0.45) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL6190006 0.80 MTTP (0.57) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL6188217 0.79 MTTP (0.48) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL6186431 0.79 MTTP (0.46) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL6192487 0.78 MTTP (0.47) MTTPCHRM2ADRA2AADORA3CHRM1
SCHEMBL6186372 0.78 MTTP (0.59) MTTPCHRM2ADRA2AADORA3CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5827875-A PYRROLIDINE DERIVATIVES; ANTIATHEROSCLEROSIS AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 1998-10-27 US disclosed