SCHEMBL31279608

SCHEMBL31279608

Cc1cccc(-n2ncc3ccc(N4CCN(C(=O)C5CCNCC5)CC4)cc32)c1

nearest known ligand 0.61

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KHK P50053 10/20 0.61
▸ MAPT P10636 4/20 0.47
▸ ADRB1 P08588 1/20 0.44
▸ LMNA P02545 3/20 0.43
▸ TP53 P04637 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ POLB P06746 1/20 0.42

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
SCHEMBL23711746 1.00 KHK (0.61) KHKMAPTADRB1LMNATP53
SCHEMBL23734198 0.85 GPR119 (0.59) KHKMAPTLMNATP53
SCHEMBL31278709 0.84 ADRB1 (0.63) KHKMAPTADRB1TP53ALDH1A1
SCHEMBL23711751 0.84 ADRB1 (0.63) KHKMAPTADRB1TP53ALDH1A1
SCHEMBL23711719 0.81 KHK (0.48) KHKMAPTLMNAALDH1A1
SCHEMBL31280556 0.81 KHK (0.48) KHKMAPTLMNAALDH1A1
SCHEMBL23711728 0.81 ADRB1 (0.58) KHKMAPTADRB1TP53ALDH1A1
SCHEMBL31279811 0.81 ADRB1 (0.58) KHKMAPTADRB1TP53ALDH1A1
SCHEMBL23734200 0.80 GPR119 (0.59) KHKMAPTLMNATP53
SCHEMBL23711736 0.80 KHK (0.49) KHKMAPTLMNA

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-20250177348-A1 Methods for Fructokinase Meditation of Alcohol Craving and Alcohol Induced Liver Disease THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE 2025-06-05 — — US disclosed
US-12161621-B2 Methods for fructokinase mediation of alcohol craving and alcohol induced liver disease THE REGENTS OF THE UNIVERSITY OF COLORADO 2024-12-10 — — 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 (2 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-12161621-B2 Methods for fructokinase mediation of alcohol craving and alcohol induced liver disease KHK, GCK, FN3K KHK 1/4885MAPT 1991/4885ADRB1 1244/4885
US-20250177348-A1 Methods for Fructokinase Meditation of Alcohol Craving and Alcohol Induced Liver Disease KHK, GCK, FN3K KHK 1/4885MAPT 1117/4885ADRB1 1745/4885

“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.

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