SCHEMBL11595366

SCHEMBL11595366

COc1ccc(N2CCN(C(=O)Cl)C2=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.51
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
NOX4 Q9NPH5 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 2/20 0.42
KDM4E B2RXH2 4/20 0.41
MAPT P10636 4/20 0.41
RECQL P46063 2/20 0.41
BLM P54132 2/20 0.41
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
THRB P10828 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
ESR1 P03372 1/20 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
SCHEMBL15328020 0.85 HDAC1 (0.48) HDAC1MEN1KMT2ANOX4L3MBTL1
SCHEMBL306677 0.80 RAB9A (0.54) HDAC1MEN1KMT2ANOX4KDM4E
SCHEMBL2670692 0.79 NPC1 (0.62) HDAC1MEN1KMT2ANPC1RAB9A
SCHEMBL11733988 0.79 KMT2A (0.58) MEN1KMT2AL3MBTL1POLBKDM4E
SCHEMBL5056199 0.76 DRD2 (0.46) HDAC1MEN1KMT2ANPC1RAB9A
SCHEMBL12427204 0.76 NOX4 (0.49) HDAC1MEN1KMT2ANOX4POLB
SCHEMBL11748028 0.74 SMN1; SMN2 (0.45) HDAC1MEN1KMT2AKDM4ENPC1
SCHEMBL11596523 0.74 ATM (0.45) MEN1KMT2APOLBRAB9ACYP2C19
SCHEMBL14734293 0.72 HDAC1 (0.56) HDAC1NOX4POLBMAPTNPC1
SCHEMBL14733322 0.72 NOX4 (0.49) HDAC1MEN1KMT2ANOX4L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4107304-A Oxo-imidazolidine substituted cephalosporins and antibacterial compositions and methods of combatting bacteria employing them BAYER AKTIENGESELLSCHAFT (DE) 1978-08-15 US disclosed
US-4093722-A ANTIBIOTICS BAYER AKTIENGESELLSCHAFT (DT) 1978-06-06 US disclosed
US-4086340-A ANTIBIOTIC; ANIMAL GROWTH PROMOTER BAYER AKTIENGESELLSCHAFT (DT) 1978-04-25 US disclosed
US-4031229-A SUBSTITUTED IMIDAZOLIDINONE-PENICILLANIC ACIDS, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-06-21 US disclosed