SCHEMBL7678459

SCHEMBL7678459

CN1CCN(Cc2[c]occ2)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.46
KDM4E B2RXH2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
LMNA P02545 1/20 0.43
CHKA P35790 3/20 0.41
CA2 P00918 1/20 0.39
NCF1 P14598 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SIGMAR1 Q99720 3/20 0.38
HRH3 Q9Y5N1 2/20 0.37
CHRNA7 P36544 1/20 0.36

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
SCHEMBL2927234 0.83 HRH3 (0.43) KDM4ENCF1PRMT6ALDH1A1SMN1; SMN2
SCHEMBL4778748 0.81 HRH3 (0.47) KDM4EALDH1A1SMN1; SMN2HRH3
SCHEMBL7672750 0.70 MC4R (0.48) MC4RKDM4ETDP1LMNACHKA
SCHEMBL26041063 0.68 MC4R (0.46) MC4RKDM4ETDP1LMNACHKA
SCHEMBL1449845 0.68 MC4R (0.55) MC4RKDM4ELMNACHKAALDH1A1
SCHEMBL21177108 0.66 MC4R (0.47) MC4RKDM4ETDP1LMNACHKA
SCHEMBL12536025 0.66 CYP2D6 (0.54) MC4RKDM4ETDP1LMNAALDH1A1
SCHEMBL12359436 0.66 MC4R (0.56) MC4RKDM4ETDP1LMNACHKA
SCHEMBL467306 0.65
SCHEMBL2972644 0.64 MC4R (0.46) MC4RKDM4ETDP1LMNACHKA

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-6455520-B1 TUMOR NECROSIS FACTOR AND INTERLEUKIN INHIBITORS; ANTIINFLAMMATORY AGENTS, ANTIALLERGENS; BONE DISORDERS ASTRA ZENECA AB (SE) 2002-09-24 US disclosed