SCHEMBL234597

SCHEMBL234597

Clc1cccnc1N1CCNCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.59
ADRB1 P08588 1/20 0.55
HTR1A P08908 1/20 0.54
SLC6A2 P23975 1/20 0.54
HTR2C P28335 1/20 0.53
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
PLD1 Q13393 1/20 0.51

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
Hydrochloric Acid SCHEMBL1737119 0.98 EPHX2 (0.58) EPHX2ADRB1HTR1ASLC6A2HTR2C
SCHEMBL28203428 0.83 HSD11B1 (0.54)
SCHEMBL31348096 0.83 HSD11B1 (0.54)
SCHEMBL11545649 0.82 HTR1A (0.68) EPHX2ADRB1HTR1ASLC6A2HTR2C
SCHEMBL30980825 0.81 CYP1A2 (0.56)
SCHEMBL3559872 0.80 HSD11B1 (0.51)
SCHEMBL10495676 0.80 HTR2C (0.68) EPHX2ADRB1HTR1ASLC6A2HTR2C
SCHEMBL3683806 0.79 HTR2C (0.61) EPHX2ADRB1HTR2C
SCHEMBL18740245 0.79 EPHX2 (0.59) EPHX2HTR1AHTR2CKDM4EALDH1A1
SCHEMBL1758382 0.79 EPHX2 (0.64) EPHX2HTR1ASLC6A2HTR2CKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4268814-A2 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF DRY EYE Universidad Miguel Hernández De Elche (ES) 2023-11-01 EP claimed
US-20250214977-A1 STAT6 INHIBITORS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2025-07-03 US disclosed
CN-112204017-B Benzisoxazole compounds 国立大学法人大阪大学 2024-08-20 CN disclosed
US-11976062-B2 Benzisoxazole compound OSAKA UNIVERSITY (JP) 2024-05-07 US disclosed
EP-3789383-B9 INHIBITORS OF THE TRPC3 OR TRPC6 CHANNEL UNIV OSAKA (JP) 2024-02-28 EP disclosed
EP-3789383-B1 INHIBITORS OF THE TRPC3 OR TRPC6 CHANNEL UNIV OSAKA (JP) 2023-11-29 EP disclosed
EP-4268814-A2 PHARMACEUTICAL COMPOSITION FOR THE TREATMENT OF DRY EYE Universidad Miguel Hernández De Elche (ES) 2023-11-01 EP disclosed
US-20230114195-A1 BENZISOXAZOLE COMPOUND KYOTO UNIVERSITY (JP) 2023-04-13 US disclosed
CN-111479813-B Triazolobenzazepines as vasopressin V1A receptor antagonists 吉瑞工厂 2023-03-21 CN disclosed
US-11548882-B2 Benzisoxazole compound OSAKA UNIVERSITY (JP) 2023-01-10 US disclosed
WO-2003068749-A1 VANILLOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2003-08-21 WO disclosed
EP-1308439-A1 PROLINE DERIVATIVES AND USE THEREOF AS DRUGS WELFIDE CORPORATION (JP) 2003-05-07 EP disclosed
US-5578596-A TREATMENT OF SEROTONERGIC NEURON RELATED DISEASES, MOTION SICKNESS, ANXIXETY, DEPRESSION ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1996-11-26 US disclosed
EP-0668276-A1 2-ALKOXY-5,6,7,8-TETRAHYDROQUINOXALINE DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-08-23 EP disclosed
EP-0376633-B1 Benzoxazepine derivatives SUNTORY LTD (JP) 1994-10-12 EP disclosed
US-5071845-A Psychotropic or anxyiolytic agent SUNTORY LIMITED (JP) 1991-12-10 US disclosed
EP-0200968-B1 SUCCINIMIDE DERIVATIVES, THEIR PRODUCTION AND USE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-08-29 EP disclosed
EP-0376633-A2 Benzoxazepine derivatives SUNTORY LIMITED (JP) 1990-07-04 EP disclosed
US-4843078-A ANXIOLYTIC AGENTS SUMITONO PHARMACEUTICAL COMPANY, LIMITED (JP) 1989-06-27 US disclosed
EP-0200968-A1 Succinimide derivatives, their production and use SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1986-11-12 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 (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-11976062-B2 Benzisoxazole compound CBR1, CYP2S1, CYP2E1 EPHX2 475/4885ADRB1 292/4885HTR1A 3719/4885
US-11548882-B2 Benzisoxazole compound CBR1, CYP2S1, CYP2E1 EPHX2 489/4885ADRB1 280/4885HTR1A 3701/4885
US-20230114195-A1 BENZISOXAZOLE COMPOUND CBR1, CYP2S1, CYP2E1 EPHX2 513/4885ADRB1 302/4885HTR1A 3598/4885
US-20250214977-A1 STAT6 INHIBITORS AND USES THEREOF STAT6, STAT5B, STAT5A EPHX2 2525/4885ADRB1 2760/4885HTR1A 4232/4885

“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.