SCHEMBL4754349

SCHEMBL4754349

Clc1ccc(OCCCBr)cc1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 4/20 0.55
DRD2 P14416 3/20 0.52
DRD3 P35462 3/20 0.52
KCNH2 Q12809 2/20 0.52
ALDH3A1 P30838 1/20 0.50
HRH3 Q9Y5N1 6/20 0.47
ALDH1A1 P00352 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL10732157 0.94 LTA4H (0.53) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL11178061 0.94 DRD4 (0.50) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL1172364 0.93 DRD4 (0.53) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL7621718 0.91 HRH3 (0.53) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL6752147 0.91 HRH3 (0.53) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL7390013 0.91 HRH3 (0.53) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL10384122 0.91 HRH3 (0.53) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL689019 0.88 DRD4 (0.52) DRD4DRD2DRD3KCNH2ALDH3A1
SCHEMBL2530176 0.88 KCNA3 (0.50) DRD4DRD2DRD3ALDH1A1SMN1; SMN2
SCHEMBL17233002 0.86 HRH3 (0.49) DRD4DRD2DRD3KCNH2ALDH3A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117105872-B Benzodiazepine compound and preparation method and application thereof 徐州医科大学 2024-10-15 CN claimed
CN-117105872-A Benzodiazepine compound and preparation method and application thereof 徐州医科大学 2023-11-24 CN claimed
EP-3704094-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-11 EP disclosed
US-20250388581-A1 ORGANIC COMPOUNDS INTRA CELLULAR THERAPIES INC (US) 2025-12-25 US disclosed
US-20250312340-A1 METHODS OF TREATING NEUROPATHIC PAIN INTRA-CELLULAR THERAPIES, INC. 2025-10-09 US disclosed
US-12331052-B2 Organic compounds INTRA-CELLULAR THERAPIES, INC. (US) 2025-06-17 US disclosed
US-20250145594-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2025-05-08 US disclosed
US-20240415832-A1 NOVEL METHODS INTRA-CELLULAR THERAPIES, INC. 2024-12-19 US disclosed
CN-117105872-B Benzodiazepine compound and preparation method and application thereof 徐州医科大学 2024-10-15 CN disclosed
EP-4419523-A1 NOVEL METHODS Intra-Cellular Therapies, Inc. (US) 2024-08-28 EP disclosed
CN-118556058-A New method 细胞内治疗公司 2024-08-27 CN disclosed
EP-0234045-A2 A pyrazole oxime derivative and its production and use NIHON NOHYAKU CO., LTD. (JP) 1987-09-02 EP disclosed
EP-0044940-B1 AMINO-DESOXY-1.4;3.6-DIANHYDRO-HEXITE NITRATES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS Dr. Willmar Schwabe GmbH & Co. (DE) 1984-09-19 EP disclosed
US-4363805-A TREATMENT OF CORONARY DISEASE FIRMA WILLMAR SCHWABE (DE) 1982-12-14 US disclosed
EP-0065864-A1 Anti-hypertensive 1-substituted spiro (piperidine-oxobenzoxazines) SYNTEX (U.S.A.) INC. (US) 1982-12-01 EP disclosed
EP-0016310-B1 MONOPHOSPHONATE COMPOUNDS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SYMPHAR S.A. (CH) 1982-09-22 EP disclosed
US-4349549-A Anti-hypertensive 1-substituted spiro(piperidine-oxobenzoxazine)s SYNTEX (U.S.A.) INC. (US) 1982-09-14 US disclosed
EP-0049060-A1 Imidazoles BEECHAM GROUP PLC (GB) 1982-04-07 EP disclosed
EP-0044940-A1 Amino-desoxy-1.4;3.6-dianhydro-hexite nitrates, processes for their preparation and pharmaceutical compositions Dr. Willmar Schwabe GmbH & Co. (DE) 1982-02-03 EP disclosed
US-4268507-A Monophosphonate compounds as hypoglycemic and/or antiartherogenic agents SYMPHAR S.A. (CH) 1981-05-19 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 (5 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-20250312340-A1 METHODS OF TREATING NEUROPATHIC PAIN GAP43, OPRK1, CNR2 DRD4 2587/4885DRD2 1772/4885DRD3 1642/4885
US-20250388581-A1 ORGANIC COMPOUNDS OPRD1, OPRM1, HTR2C DRD4 29/4885DRD2 7/4885DRD3 24/4885
US-12331052-B2 Organic compounds OPRD1, OPRK1, OPRM1 DRD4 37/4885DRD2 13/4885DRD3 27/4885
US-20240415832-A1 NOVEL METHODS OPRK1, OPRD1, OPRM1 DRD4 279/4885DRD2 258/4885DRD3 201/4885
US-20250145594-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 DRD4 3651/4885DRD2 3122/4885DRD3 3391/4885

“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.