SCHEMBL10109387

SCHEMBL10109387

CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnn(C(C)(C)C)n2)cc1)C(C(=O)O)C(C)C

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 15/20 0.68
LTB4R2 Q9NPC1 6/20 0.68
ABCB11 O95342 1/20 0.68
GP6 Q9HCN6 1/20 0.68
AGTR2 P50052 2/20 0.40

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
SCHEMBL4809836 0.93 AGTR1 (0.65) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL4809851 0.93 AGTR1 (0.65) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2930431 0.92 AGTR1 (0.66) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL2930427 0.92 AGTR1 (0.66) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL28456708 0.92 AGTR1 (0.66) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL8204220 0.89 AGTR1 (0.71) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL8818935 0.84 AGTR1 (0.54) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL8819112 0.84 AGTR1 (0.54) AGTR1LTB4R2ABCB11GP6AGTR2
SCHEMBL10109393 0.84 AGTR1 (0.64) AGTR1LTB4R2ABCB11GP6
SCHEMBL8263258 0.83 AGTR1 (0.61) AGTR1LTB4R2ABCB11GP6AGTR2

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-8101782-B2 Drug hybrid of rivastigmine or physostigmine with tranylcypromine, amoxapine, desipramine, nortriptyline, protriptyline, fluoxetine, fluvoxamine, paroxetine, duloxetine, betahistine, amlodipine, proylhexedrine, rimantadine, desloratadine; Alzheimer's disease; Parkinson's disease, impairment in memory COLUCID PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
US-8101782-B2 Drug hybrid of rivastigmine or physostigmine with tranylcypromine, amoxapine, desipramine, nortriptyline, protriptyline, fluoxetine, fluvoxamine, paroxetine, duloxetine, betahistine, amlodipine, proylhexedrine, rimantadine, desloratadine; Alzheimer's disease; Parkinson's disease, impairment in memory COLUCID PHARMACEUTICALS, INC. (US) 2012-01-24 US disclosed
US-20080261950-A1 Compounds that inhibit cholinesterase COLUCID PHARMACEUTICALS, INC. (US) 2008-10-23 US disclosed
US-20080261950-A1 Compounds that inhibit cholinesterase COLUCID PHARMACEUTICALS, INC. (US) 2008-10-23 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-20080261950-A1 Compounds that inhibit cholinesterase ACHE, BCHE, CHAT AGTR1 2377/4885LTB4R2 1575/4885ABCB11 836/4885

“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.