SCHEMBL32680680

SCHEMBL32680680

N#Cc1ccc2c(c1)CCN=C2

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.43
CYP11B2 P19099 5/20 0.43
PNMT P11086 6/20 0.42
DRD2 P14416 4/20 0.42
DRD3 P35462 4/20 0.42
TRPA1 O75762 1/20 0.39
KDM1A O60341 2/20 0.35
CYP19A1 P11511 4/20 0.34
CYP1A2 P05177 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
SCHEMBL27984426 1.00 CYP11B1 (0.43) CYP11B1CYP11B2PNMTDRD2DRD3
SCHEMBL28331918 0.86 TRPA1 (0.49) CYP11B1CYP11B2PNMTDRD2DRD3
SCHEMBL9573469 0.72 DRD2 (0.37) DRD2DRD3TRPA1
SCHEMBL29769963 0.72 CASP1 (0.37) DRD3
SCHEMBL9573205 0.72 HTR2A (0.38) CYP11B1CYP11B2PNMTKDM1ACYP19A1
SCHEMBL17288494 0.72 PNMT (0.46) CYP11B1CYP11B2PNMTDRD2DRD3
SCHEMBL30025550 0.72 ADRA2A (0.34) CYP1A2
SCHEMBL28191945 0.72
SCHEMBL9573203 0.72 CYP19A1 (0.33) CYP11B1CYP11B2CYP19A1
SCHEMBL7938077 0.72 ADRA2A (0.34) CYP1A2

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-20260062443-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS ALEXION PHARMA INC (US) 2026-03-05 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-20260062443-A1 PHARMACEUTICAL COMPOUNDS FOR THE TREATMENT OF COMPLEMENT MEDIATED DISORDERS C9, SSB, C1S CYP11B1 2896/4885CYP11B2 2659/4885PNMT 4716/4885

“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.