SCHEMBL11735474

SCHEMBL11735474

CC(=O)N1CC(C)N(C(=O)Cl)C1=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 6/20 0.38
MAPK1 P28482 1/20 0.35
NOTUM Q6P988 2/20 0.34
POLB P06746 1/20 0.32
NSD2 O96028 1/20 0.32
ATM Q13315 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CHRNB3 Q05901 1/20 0.31
CHRNA6 Q15825 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
SCHEMBL11737994 0.85 BRD4 (0.40) BRD4MAPK1NOTUMPOLBNSD2
SCHEMBL11730931 0.81 TSHR (0.43) BRD4CHRNB2CHRNA3CHRNA4
SCHEMBL11734269 0.81 CREBBP (0.34) POLB
SCHEMBL11734072 0.74 POLB (0.31) POLB
SCHEMBL11727431 0.74 TSHR (0.43) BRD4CHRNB2CHRNA3CHRNA4
SCHEMBL11364967 0.73 MAPK1 (0.42) BRD4MAPK1NOTUMPOLB
SCHEMBL11740390 0.73
SCHEMBL29050324 0.72 ACE (0.42) MAPK1NOTUMPOLBATM
SCHEMBL11727874 0.70 BRD4 (0.39) BRD4
SCHEMBL11732992 0.69 TSHR (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4009272-A ANTIBIOTIC BAYER AKTIENGESELLSCHAFT (DT) 1977-02-22 US disclosed
US-3983105-A Penicillins BAYER AKTIENGESELLSCHAFT (DT) 1976-09-28 US disclosed
US-3978056-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-31 US disclosed
US-3975375-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-17 US disclosed
US-3974142-A BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 US disclosed
US-3974141-A IMIDAZOLIDINYL-CARBAMIDOBACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-10 US disclosed
US-3972869-A Penicillins BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 US disclosed
US-3972870-A IMIDAZOLIDINYL-CARBAMIDO-BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-08-03 US disclosed