SCHEMBL7242580

SCHEMBL7242580

CC1=C(NC=O)C(c2ccc([N+](=O)[O-])cc2)C(N(C=O)CCCN2CCC(C(=O)OCCC#N)(c3ccccc3)CC2)=CN1C

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 17/20 0.55
ADRA1D P25100 13/20 0.45
ADRA1B P35368 13/20 0.45
ADRA2A P08913 4/20 0.45
ADRA2B P18089 4/20 0.45
ADRA2C P18825 4/20 0.45
SIGMAR1 Q99720 2/20 0.43

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
SCHEMBL7246889 0.88 ADRA1A (0.60) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7236482 0.85 ADRA1A (0.55) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7952573 0.80 ADRA1A (0.74) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7246347 0.80 ADRA1A (0.57) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7242493 0.78 ADRA1A (0.60) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL9392170 0.78 ADRA1A (0.69) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7245997 0.78 ADRA1A (0.55) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7237001 0.77 ADRA1A (0.60) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7954084 0.76 ADRA1A (0.56) ADRA1AADRA1DADRA1BADRA2AADRA2B
SCHEMBL7690732 0.76 ADRA1A (0.51) ADRA1AADRA1DADRA1BADRA2AADRA2B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6608086-B2 Selective adrenergic receptor alpha 1C antagonists without significant calcium channel activity; treating benign prostatic hyperplasia, intraocular pressure and inhibiting cholesterol synthesis SYNAPTIC PHARMACEUTICAL CORPORATION 2003-08-19 US disclosed
US-20020193599-A1 Dihydropyridines and new uses thereof SYNAPTIC PHARMACEUTICAL CORPORATION 2002-12-19 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-20020193599-A1 Dihydropyridines and new uses thereof BPHL, BCKDK, DHCR7 ADRA1A 73/4885ADRA1D 77/4885ADRA1B 43/4885

“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.