SCHEMBL7989362

SCHEMBL7989362

C=CCCCN(C)C(=O)[C@@H](N)Cc1c[nH]c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
MAPT P10636 2/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
MPO P05164 1/20 0.55
TSHR P16473 1/20 0.55
BLM P54132 1/20 0.55
PMP22 Q01453 1/20 0.55
KMT2A Q03164 1/20 0.55
HIF1A Q16665 1/20 0.55
MC4R P32245 2/20 0.52
MC5R P33032 1/20 0.52
MC3R P41968 1/20 0.52
HTR2A P28223 3/20 0.47
CDK4 P11802 3/20 0.47
CCND1 P24385 3/20 0.47
HTR1A P08908 2/20 0.47
ADRA2A P08913 2/20 0.47
HTR1B P28222 2/20 0.47
HTR2C P28335 2/20 0.47

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
SCHEMBL7620106 0.84 CDK4 (0.66) KDM4EMAPTMEN1LMNAMPO
SCHEMBL7976198 0.84 TACR1 (0.59) TACR1MMP9MMP8MMP14
SCHEMBL7976201 0.84 TACR1 (0.59) TACR1MMP9MMP8MMP14
SCHEMBL7990061 0.81 NLN (0.49) KDM4EMAPTMEN1KMT2APOLB
SCHEMBL2992113 0.80 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO
SCHEMBL4126005 0.80 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO
SCHEMBL21292830 0.80 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO
SCHEMBL8345144 0.79 TACR1 (0.69) KDM4EMAPTMEN1LMNAMPO
SCHEMBL8345148 0.79 TACR1 (0.69) KDM4EMAPTMEN1LMNAMPO
SCHEMBL30230046 0.79 TACR1 (0.69) KDM4EMAPTMEN1LMNAMPO

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
WO-2001040198-A2 MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS AVENTIS PHARMA S.A. (FR) 2001-06-07 WO disclosed