SCHEMBL5213485

SCHEMBL5213485

CC1(C(=O)OCc2ccccc2)CCNCC1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.51
CRBN Q96SW2 1/20 0.51
OPRM1 P35372 1/20 0.50
ALDH1A1 P00352 2/20 0.49
HTR2C P28335 1/20 0.46
TACR1 P25103 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
SCHEMBL23582686 0.91 DDB1 (0.49) DDB1CRBNOPRM1ALDH1A1HTR2C
SCHEMBL12621202 0.86 ALDH1A1 (0.53) DDB1CRBNALDH1A1
SCHEMBL18692576 0.86 ALDH1A1 (0.53) DDB1CRBNALDH1A1
SCHEMBL16104359 0.84 DDB1 (0.54) DDB1CRBNOPRM1ALDH1A1TACR1
SCHEMBL20221555 0.84 ALDH1A1 (0.51) DDB1CRBNALDH1A1
SCHEMBL13311996 0.83 DDB1 (0.56) DDB1CRBNOPRM1ALDH1A1TACR1
SCHEMBL26130614 0.83 DDB1 (0.52) DDB1CRBNOPRM1ALDH1A1HTR2C
SCHEMBL5217465 0.83 DDB1 (0.47) DDB1CRBNALDH1A1HTR2C
SCHEMBL5215704 0.83 DDB1 (0.47) DDB1CRBNALDH1A1HTR2C
SCHEMBL5215715 0.83 DDB1 (0.47) DDB1CRBNALDH1A1HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250263405-A1 HISTONE DEACETYLASE 6 INHIBITOR COMPOUNDS AND USES THEREOF VALO HEALTH, INC. 2025-08-21 US disclosed
EP-4426285-A1 HISTONE DEACETYLASE 6 INHIBITOR COMPOUNDS AND USES THEREOF Valo Health, Inc. (US) 2024-09-11 EP disclosed
US-20230219954-A1 P2X3 AND/OR P2X2/3 COMPOUNDS AND METHODS ASANA BIOSCIENCES, LLC 2023-07-13 US disclosed
US-11685736-B2 P2X3 and/or P2X2/3 compounds and methods ABS DEVELOPMENT 1, INC. (US) 2023-06-27 US disclosed
WO-2023081328-A1 HISTONE DEACETYLASE 6 INHIBITOR COMPOUNDS AND USES THEREOF VALO HEALTH, INC. (US) 2023-05-11 WO disclosed
WO-2023081328-A1 HISTONE DEACETYLASE 6 INHIBITOR COMPOUNDS AND USES THEREOF VALO HEALTH, INC. (US) 2023-05-11 WO disclosed
EP-3083619-B1 P2X3 AND/OR P2X2/3 COMPOUNDS AND METHODS ASANA BIOSCIENCES LLC (US) 2021-11-03 EP disclosed
US-20200109143-A1 P2X3 AND/OR P2X2/3 COMPOUNDS AND METHODS ABS DEVELOPMENT 1, INC. 2020-04-09 US disclosed
US-10590127-B2 P2X3 and/or P2X2/3 compounds and methods ASANA BIOSCIENCES, LLC (US) 2020-03-17 US disclosed
US-10544145-B2 P2X3 and/or P2X2/3 compounds and methods ASANA BIOSCIENCES, LLC (US) 2020-01-28 US disclosed
EP-1165540-B1 TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME (GB) 2003-08-13 EP disclosed
EP-1322596-A1 ZWITTERIONIC TACHYKININ RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 2003-07-02 EP disclosed
US-6479518-B2 PSYCHOLOGICAL DISORDERS MERCK & CO., INC. 2002-11-12 US disclosed
US-6458830-B1 THE COMPOUNDS ARE OF PARTICULAR USE IN THE TREATMENT OR PREVENTION OF DEPRESSION, ANXIETY, PAIN, INFLAMMATION, MIGRAINE, EMESIS AND POSTHERPETIC NEURALGIA. MERCK SHARP & DOHME LTD. 2002-10-01 US disclosed
US-20020042431-A1 Zwitterionic tachykinin receptor antagonists MERCK & CO., INC. 2002-04-11 US disclosed
CN-1344264-A Tetrahydropyran derivatives and their use as therapeutic agents MERCK SHARP & DOHME (GB) 2002-04-10 CN disclosed
WO-2002024629-A1 ZWITTERIONIC TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2002-03-28 WO disclosed
EP-1165540-A1 TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 2002-01-02 EP disclosed
WO-2000056728-A1 TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2000-09-28 WO disclosed
WO-2000056727-A1 TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 2000-09-28 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 (7 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-20020042431-A1 Zwitterionic tachykinin receptor antagonists NPY5R, NPY1R, NPY2R DDB1 4170/4885CRBN 3505/4885OPRM1 163/4885
US-10544145-B2 P2X3 and/or P2X2/3 compounds and methods P2RX3, P2RX2, P2RX1 DDB1 3136/4885CRBN 1741/4885OPRM1 81/4885
US-20230219954-A1 P2X3 AND/OR P2X2/3 COMPOUNDS AND METHODS P2RX3, P2RX2, P2RX1 DDB1 3136/4885CRBN 1741/4885OPRM1 81/4885
US-10590127-B2 P2X3 and/or P2X2/3 compounds and methods P2RX3, P2RX2, P2RX1 DDB1 3028/4885CRBN 1791/4885OPRM1 75/4885
US-20200109143-A1 P2X3 AND/OR P2X2/3 COMPOUNDS AND METHODS P2RX3, P2RX2, P2RX1 DDB1 3136/4885CRBN 1741/4885OPRM1 81/4885
US-20250263405-A1 HISTONE DEACETYLASE 6 INHIBITOR COMPOUNDS AND USES THEREOF HDAC6, HDAC1, HDAC3 DDB1 1384/4885CRBN 1544/4885OPRM1 4679/4885
US-11685736-B2 P2X3 and/or P2X2/3 compounds and methods P2RX3, P2RX2, P2RX1 DDB1 3136/4885CRBN 1741/4885OPRM1 81/4885

“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.