SCHEMBL1986267

SCHEMBL1986267

c1cc(-c2ccncc2)c2[nH]c3c(c2c1)C1CCC(C3)N1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.53
CHRNB2 P17787 3/20 0.41
CHRNA3 P32297 2/20 0.41
HTR6 P50406 4/20 0.40
CHRNA4 P43681 2/20 0.37
MCHR1 Q99705 3/20 0.34
IMPDH2 P12268 1/20 0.34
CHRNA7 P36544 1/20 0.34
PIK3CD O00329 1/20 0.33

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
SCHEMBL1985022 0.87 CHRNB2 (0.51) SIGMAR1CHRNB2CHRNA3HTR6CHRNA4
SCHEMBL1986344 0.81 CHRNB2 (0.51) SIGMAR1CHRNB2CHRNA3HTR6CHRNA4
SCHEMBL1986919 0.77 CHRNB2 (0.47) SIGMAR1CHRNB2CHRNA3HTR6CHRNA4
SCHEMBL1445173 0.70 SIGMAR1 (1.00) SIGMAR1HTR6MCHR1
SCHEMBL1990392 0.67 SIGMAR1 (0.46) SIGMAR1HTR6MCHR1CHRNA7
SCHEMBL1985517 0.67 SIGMAR1 (0.46) SIGMAR1HTR6MCHR1CHRNA7
SCHEMBL1985618 0.67 SIGMAR1 (0.46) SIGMAR1HTR6MCHR1CHRNA7
SCHEMBL2811353 0.67 SIGMAR1 (0.48) SIGMAR1HTR6
SCHEMBL1991893 0.64 CDK4 (0.36) IMPDH2PIK3CD
SCHEMBL28852044 0.64 IMPDH2 (0.53) IMPDH2PIK3CD

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 SIGMAR1 2033/4885CHRNB2 549/4885CHRNA3 262/4885

“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.