SCHEMBL2056217

SCHEMBL2056217

CN1CCN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CC1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 3/20 0.86
▸ ADRA2A P08913 3/20 0.86
▸ CHRM1 P11229 3/20 0.86
▸ DRD1 P21728 3/20 0.86
▸ DRD3 P35462 3/20 0.86
▸ SLC6A3 Q01959 3/20 0.86
▸ KCNH2 Q12809 3/20 0.86
▸ HTR1A P08908 2/20 0.86
▸ TBXA2R P21731 2/20 0.86
▸ SLC6A2 P23975 2/20 0.86
▸ SLC6A4 P31645 2/20 0.86
▸ ADRA1A P35348 2/20 0.86
▸ BCL2 P10415 1/20 0.86
▸ HRH3 Q9Y5N1 1/20 0.86
▸ CYP2D6 P10635 4/20 0.83
▸ TSHR P16473 3/20 0.83
▸ CYP2C19 P33261 1/20 0.83
▸ TDP1 Q9NUW8 1/20 0.83
▸ SMN1; SMN2 Q16637 2/20 0.76
▸ OPRM1 P35372 2/20 0.76

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
Chlorcyclizine SCHEMBL16769331 0.93 KCNH2 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
Chlorcyclizine SCHEMBL4383 0.93 KCNH2 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
Chlorcyclizine SCHEMBL12157065 0.93 KCNH2 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
Chlorcyclizine SCHEMBL13724147 0.93 KCNH2 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
Chlorcyclizine SCHEMBL321657 0.91 CYP2D6 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
Homochlorcyclizine SCHEMBL30402 0.87 DRD3 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
Homochlorcyclizine SCHEMBL1977999 0.86 SMN1; SMN2 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
Homochlorcyclizine SCHEMBL122573 0.86 SMN1; SMN2 (1.00) CHRM2ADRA2ACHRM1DRD1DRD3
SCHEMBL10677115 0.86 CHRM2 (0.70) CHRM2ADRA2ACHRM1DRD1DRD3
SCHEMBL25068897 0.84 CHRM2 (0.64) CHRM2ADRA2ACHRM1DRD1DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230055961-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF DUNAD THERAPEUTICS LTD. (GB) 2023-02-23 — — US disclosed
WO-2022119362-A1 GPX4 PROTEIN DEGRADATION-INDUCING COMPOUND (주) 업테라 2022-06-09 — — WO disclosed
US-20170001988-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS AND CANCER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2017-01-05 — — US disclosed
US-20170001988-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS AND CANCER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2017-01-05 — — US disclosed
US-20170001988-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS AND CANCER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2017-01-05 — — US disclosed
EP-3074001-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS AND CANCER The U.S.A. As Represented By The Secretary, Department Of Health And Human Services (US) 2016-10-05 — — EP disclosed
WO-2015080949-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS AND CANCER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2015-06-04 — — WO disclosed
WO-2015080949-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS AND CANCER THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2015-06-04 — — WO disclosed
US-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 — — US disclosed
US-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 — — US disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 — — EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 — — US disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 — — US disclosed
US-6221868-B1 Remedies/preventives for frequent urination/urinary incontinence and tropone derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-04-24 — — US disclosed
EP-0995741-A1 REMEDIES/PREVENTIVES FOR FREQUENT URINATION/URINARY INCONTINENCE AND TROPONE DERIVATIVES Nippon Kayaku Kabushiki Kaisha (JP) 2000-04-26 — — 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-20170001988-A1 PIPERIDINE AND PIPERAZINE DERIVATIVES AND THEIR USE IN TREATING VIRAL INFECTIONS AND CANCER NCOR1, RRP15, NCOA1 CHRM2 1157/4885ADRA2A 1044/4885CHRM1 420/4885
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 CHRM2 776/4885ADRA2A 583/4885CHRM1 575/4885
US-20230055961-A1 PENTAFLUOROBENZENESULFONAMIDE DERIVATIVES AND USES THEREOF FURIN, PFAS, CFTR CHRM2 3400/4885ADRA2A 3550/4885CHRM1 4319/4885

“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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