SCHEMBL3084832

SCHEMBL3084832

Cc1ccc(OCCl)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
DRD2 P14416 5/20 0.48
DRD4 P21917 5/20 0.48
DRD3 P35462 5/20 0.48
WDR5 P61964 1/20 0.48
ACHE P22303 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
KCNH2 Q12809 1/20 0.45
HPGD P15428 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NQO1 P15559 1/20 0.43
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HRH3 Q9Y5N1 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
Trimethylammonium SCHEMBL22264983 0.93 KCNH2 (0.46) LMNADRD2DRD4DRD3WDR5
SCHEMBL11770355 0.86 NQO1 (0.47) LMNANQO1TDP1
SCHEMBL2410855 0.80 DRD2 (0.61) DRD2DRD4DRD3L3MBTL1KCNH2
SCHEMBL5825048 0.80 DRD2 (0.55) DRD2DRD4DRD3WDR5L3MBTL1
SCHEMBL1148163 0.79 NQO1 (0.74) NQO1MAPTTDP1
SCHEMBL7029327 0.79 CA1 (0.58) ACHEL3MBTL1NPSR1MAPTTDP1
SCHEMBL6298426 0.78 DRD2 (0.59) DRD2DRD4DRD3L3MBTL1KCNH2
SCHEMBL1688857 0.78 ACHE (0.52) DRD2DRD4DRD3WDR5ACHE
SCHEMBL313373 0.78 DRD2 (0.64) DRD2DRD4DRD3WDR5ACHE
SCHEMBL20530526 0.77 DRD2 (0.57) DRD2DRD4DRD3L3MBTL1KCNH2

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3802492-B1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS THE INSTITUTE OF CANCER RES ROYAL CANCER HOSPITAL (GB) 2024-11-06 EP disclosed
US-11970469-B2 Compounds useful in the treatment of disorders associated with mutant RAS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2024-04-30 US disclosed
US-20210214322-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2021-07-15 US disclosed
EP-3802492-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS Oxford University Innovation Limited (GB) 2021-04-14 EP disclosed
WO-2019234405-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2019-12-12 WO disclosed
CN-106795118-B Heterocyclic compound and their purposes as relevant orphan receptor (ROR) the GAMMA-T inhibitor of retinoids 武田药品工业株式会社 2019-10-08 CN disclosed
CN-109942560-A MACROCYCLIZATION REACTIONS AND INTERMEDIATES USEFUL IN THE SYNTHESIS OF ANALOGS OF HALICHONDRIN B 卫材R&D管理有限公司 2019-06-28 CN disclosed
CN-105683198-B Macrocyclization reactions and intermediates useful in the synthesis of analogs of halichondrin B 卫材R&D管理有限公司 2019-03-12 CN disclosed
CN-104470925-B Imidazo-triazine formonitrile HCN as kinase inhibitor 百时美施贵宝公司 2017-12-05 CN disclosed
CN-106795118-A Heterocyclic compound to they as related orphan receptor (ROR) the GAMMA T inhibitor of retinoids purposes 武田药品工业株式会社 2017-05-31 CN disclosed
CN-103209954-A 4-substituted-3-benzyloxy-bicyclo [3.1.0] hexane compounds as mGluR 2/3 antagonists LILLY CO ELI 2013-07-17 CN disclosed
CN-102232075-A Aminopyrazole compounds LILLY CO ELI 2011-11-02 CN disclosed
CN-1875054-B Charge-transporting compound, charge-transporting material, charge-transporting varnish, charge-transporting thin film, and organic electroluminescent device NISSAN CHEMICAL IND LTD 2011-05-25 CN disclosed
US-20100230634-A1 METHOD FOR PRODUCING BIPHENYL DERIVATIVE Hayashi, Tamio (JP) 2010-09-16 US disclosed
CN-1875054-A Charge-transporting compound, charge-transporting material, charge-transporting varnish, charge-transporting thin film, and organic electroluminescent device NISSAN CHEMICAL IND LTD (JP) 2006-12-06 CN disclosed
US-4835312-A Production process of N-substituted amide compounds MITSUI CHEMICALS, INCORPORATED (JP) 1989-05-30 US disclosed
US-4705791-A ANTICARCINOGENIC AGENTS, IMMUNOLOGY, SKIN DISORDERS NYEGAARD & CO. A/S (NO) 1987-11-10 US disclosed
US-4596870-A Substituted pyrimidin-2-ones and the salts thereof NYEGAARD & CO. A.S. (NO) 1986-06-24 US disclosed
EP-0056319-B1 SUBSTITUTED PYRIMIDIN-2-ONES AND THE SALTS THEREOF NYEGAARD & CO. A/S (NO) 1986-04-16 EP disclosed
EP-0056319-A2 Substituted pyrimidin-2-ones and the salts thereof NYEGAARD & CO. A/S (NO) 1982-07-21 EP 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 (3 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-20210214322-A1 COMPOUNDS USEFUL IN THE TREATMENT OF DISORDERS ASSOCIATED WITH MUTANT RAS KRAS, NRAS, HRAS LMNA 3363/4885DRD2 4780/4885DRD4 4782/4885
US-11970469-B2 Compounds useful in the treatment of disorders associated with mutant RAS KRAS, NRAS, HRAS LMNA 3363/4885DRD2 4780/4885DRD4 4782/4885
US-20100230634-A1 METHOD FOR PRODUCING BIPHENYL DERIVATIVE CYP2E1, DDT, B2M LMNA 2726/4885DRD2 753/4885DRD4 117/4885

“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.