SCHEMBL1325960

SCHEMBL1325960

CCCN1CCc2cc(O)cc3c2[C@H]1Cc1ccc(O)c(O)c1-3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 1.00
▸ MAPK1 P28482 5/20 1.00
▸ ALDH1A1 P00352 4/20 1.00
▸ RGS12 O14924 3/20 1.00
▸ CYP1A2 P05177 3/20 1.00
▸ THPO P40225 3/20 1.00
▸ MTOR P42345 3/20 1.00
▸ GNAI1 P63096 3/20 1.00
▸ HIF1A Q16665 3/20 1.00
▸ HSD17B10 Q99714 3/20 1.00
▸ TP53 P04637 2/20 1.00
▸ CYP2D6 P10635 2/20 1.00
▸ NFKB1 P19838 2/20 1.00
▸ CYP2C9 P11712 1/20 1.00
▸ KDM4E B2RXH2 4/20 0.98
▸ LMNA P02545 4/20 0.98
▸ HPGD P15428 4/20 0.98
▸ PMP22 Q01453 4/20 0.98
▸ KMT2A Q03164 4/20 0.98
▸ NPSR1 Q6W5P4 2/20 0.98

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
SCHEMBL1325958 1.00 MAPT (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
SCHEMBL29380552 1.00 MAPT (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
Bromide SCHEMBL1325232 0.99 MAPT (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
Bromide SCHEMBL1325230 0.99 MAPT (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
SCHEMBL10955950 0.92 MAPT (0.85) MAPTMAPK1ALDH1A1RGS12CYP1A2
SCHEMBL12878037 0.90 DRD1 (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
SCHEMBL12284387 0.89 DRD3 (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
SCHEMBL14535819 0.89 DRD3 (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
SCHEMBL12284193 0.87 DRD3 (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2
SCHEMBL29387586 0.87 DRD3 (1.00) MAPTMAPK1ALDH1A1RGS12CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220125379-A1 METHODS FOR IDENTIFYING RESPONDERS TO DOPAMINERGIC NEURONAL ENHANCING THERAPIES FOR THE TREATMENT OF ELEVATED HEART RATE AND METABOLIC OR CARDIOVASCULAR CONDITIONS VEROSCIENCE LLC (US) 2022-04-28 — — US disclosed
US-20220079899-A1 COMPOSITIONS AND METHODS FOR TREATING OCULAR CONDITIONS UNITED STATES GOVERNMENT 2022-03-17 — — US disclosed
US-20170340271-A1 METHODS FOR IDENTIFYING RESPONDERS TO DOPAMINERGIC NEURONAL ENHANCING THERAPIES FOR THE TREATMENT OF ELEVATED HEART RATE AND METABOLIC OR CARDIOVASCULAR CONDITIONS VEROSCIENCE LLC (US) 2017-11-30 — — US disclosed
US-20160068569-A1 STRUCTURE-BASED PEPTIDE INHIBITORS OF P53 AGGREGATION AS A NEW APPROACH TO CANCER THERAPEUTICS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-03-10 — — US disclosed
US-20140275224-A1 CYTOSINE DEAMINASE MODULATORS FOR ENHANCEMENT OF DNA TRANSFECTION REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2014-09-18 — — US disclosed
US-20140275224-A1 CYTOSINE DEAMINASE MODULATORS FOR ENHANCEMENT OF DNA TRANSFECTION REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2014-09-18 — — US disclosed
WO-2013074059-A2 CYTOSINE DEAMINASE MODULATORS FOR ENHANCEMENT OF DNA TRANSFECTION REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2013-05-23 — — WO disclosed
US-8058243-B2 Method for treating a brain cancer with ifenprodil HSC RESEARCH AND DEVELOPMENT LIMITED PARTNERSHIP (CA) 2011-11-15 — — US disclosed
US-20110218158-A1 DNA CYTOSINE DEAMINASE INHIBITORS REGENTS OF THE UNIVERSITY OF MINNESOTA 2011-09-08 — — US disclosed
US-20110218158-A1 DNA CYTOSINE DEAMINASE INHIBITORS REGENTS OF THE UNIVERSITY OF MINNESOTA 2011-09-08 — — US disclosed
WO-2010033986-A2 DNA CYTOSINE DEAMINASE INHIBITORS REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2010-03-25 — — WO 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 (4 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-20220079899-A1 COMPOSITIONS AND METHODS FOR TREATING OCULAR CONDITIONS ENPP1, ENPP3, ENPP2 MAPT 3025/4885MAPK1 2088/4885ALDH1A1 1417/4885
US-20110218158-A1 DNA CYTOSINE DEAMINASE INHIBITORS DCTD, APOBEC3A, UNG MAPT 4260/4885MAPK1 4366/4885ALDH1A1 795/4885
US-20160068569-A1 STRUCTURE-BASED PEPTIDE INHIBITORS OF P53 AGGREGATION AS A NEW APPROACH TO CANCER THERAPEUTICS TP53, TP53BP1, API5 MAPT 32/4885MAPK1 2475/4885ALDH1A1 4635/4885
US-20140275224-A1 CYTOSINE DEAMINASE MODULATORS FOR ENHANCEMENT OF DNA TRANSFECTION CDA, DCTD, ADA MAPT 4829/4885MAPK1 4614/4885ALDH1A1 2191/4885

“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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