SCHEMBL7679298

SCHEMBL7679298

CN1CCN(Cc2[c]sc3ccccc23)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.47
HTR6 P50406 3/20 0.44
LMNA P02545 2/20 0.44
CHKA P35790 2/20 0.39
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CHRNA7 P36544 1/20 0.38
HRH4 Q9H3N8 1/20 0.38
ERN1 O75460 1/20 0.38
NPC1 O15118 1/20 0.38
TP53 P04637 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL3136356 0.68 GPR3 (0.36)
Hydrochloric Acid SCHEMBL11531395 0.66 MC4R (0.46) MC4RHTR6CHKAPOLBKDM4E
SCHEMBL221139 0.65 MC4R (1.00) MC4RLMNACHKAPOLBHRH4
SCHEMBL2316820 0.65 MC4R (1.00) MC4RLMNACHKAPOLBHRH4
SCHEMBL1044943 0.65 MC4R (1.00) MC4RLMNACHKAPOLBHRH4
SCHEMBL7654044 0.65 HTT (0.68) MC4RPOLBKDM4ETDP1
SCHEMBL7672750 0.65 MC4R (0.48) MC4RLMNACHKAKDM4ETDP1
SCHEMBL2511838 0.65 ERN1 (0.64) MC4RHTR6CHKAPOLBKDM4E
SCHEMBL12123080 0.65 ACHE (0.67) MC4RHTR6KDM4ETDP1
SCHEMBL13499604 0.65 FAAH (0.57) MC4RCHKAKDM4ETDP1HRH4

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