SCHEMBL1991565

SCHEMBL1991565

CC(=O)N1C2CCC1c1c([nH]c3c(-c4ccc(Cl)nc4)cccc13)C2

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.40
SIGMAR1 Q99720 8/20 0.36
PIK3CA P42336 1/20 0.35
KCNK3 O14649 1/20 0.34
CFTR P13569 2/20 0.34
BRAF P15056 1/20 0.32

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
SCHEMBL1987756 0.81 MCHR1 (0.39) MCHR1
SCHEMBL1986344 0.73 CHRNB2 (0.51) MCHR1SIGMAR1
SCHEMBL1986919 0.71 CHRNB2 (0.47) MCHR1SIGMAR1
SCHEMBL16210988 0.64 MCHR1 (0.40) MCHR1SIGMAR1KCNK3CFTR
SCHEMBL14791442 0.62 MAPK1 (0.47) MCHR1KCNK3CFTR
SCHEMBL1984652 0.62 CHRNB2 (0.38)
SCHEMBL31156183 0.57 MEN1 (0.47)
SCHEMBL4933140 0.57 MEN1 (0.47)
SCHEMBL15869581 0.56 SIGMAR1 (0.57) MCHR1SIGMAR1
SCHEMBL2494858 0.56 RET (0.37) KCNK3

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-8778959-B2 AZA-bridged ring-fused indoles and indolines ABBVIE INC. (US) 2014-07-15 US claimed
US-20110152306-A1 AZA-BRIDGED RING-FUSED INDOLES AND INDOLINES ABBOTT LABORATORIES (US) 2011-06-23 US claimed
US-8778959-B2 AZA-bridged ring-fused indoles and indolines ABBVIE INC. (US) 2014-07-15 US disclosed
US-20110152306-A1 AZA-BRIDGED RING-FUSED INDOLES AND INDOLINES ABBOTT LABORATORIES (US) 2011-06-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110152306-A1 AZA-BRIDGED RING-FUSED INDOLES AND INDOLINES INMT, IDO1, IDO2 MCHR1 591/4885SIGMAR1 2033/4885PIK3CA 2938/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.