SCHEMBL2409709

SCHEMBL2409709

CCC(=O)C1CCNCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.52
TSHR P16473 2/20 0.52
GABRG2 P18507 2/20 0.52
GABRB3 P28472 2/20 0.52
GABRA5 P31644 2/20 0.52
GABRA3 P34903 2/20 0.52
GABRA2 P47869 2/20 0.52
GABRA6 Q16445 2/20 0.52
GABRP O00591 1/20 0.52
GABRD O14764 1/20 0.52
GABRB1 P18505 1/20 0.52
GABRB2 P47870 1/20 0.52
GABRA4 P48169 1/20 0.52
GABRE P78334 1/20 0.52
PMP22 Q01453 1/20 0.52
GABRG1 Q8N1C3 1/20 0.52
GABRG3 Q99928 1/20 0.52
GABRQ Q9UN88 1/20 0.52
GNAI3 P08754 2/20 0.44
GNAO1 P09471 2/20 0.44

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
SCHEMBL27840525 0.94 GABRP (0.46) GABRA1TSHRGABRG2GABRB3GABRA5
SCHEMBL22053158 0.90 TSHR (0.43) GABRA1TSHRGABRG2GABRB3GABRA5
SCHEMBL27712231 0.88 MEN1 (0.45) GABRA1TSHRGABRG2GABRB3GABRA5
SCHEMBL25015448 0.86
SCHEMBL24073181 0.86
SCHEMBL14218506 0.86
SCHEMBL256670 0.84
SCHEMBL3949885 0.82 GABRP (0.48) GABRA1TSHRGABRG2GABRB3GABRA5
Fluorobenzene SCHEMBL27513887 0.81 SLC6A2 (0.40) GABRA1TSHRGABRG2GABRB3GABRA5
Hydrochloric Acid SCHEMBL20508301 0.80 GNAI3 (0.49) GABRA1TSHRGABRG2GABRB3GABRA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101795689-B Positive allosteric modulators of benzamide mGluR5 and methods of making and using the same UNIV VANDERBILT 2014-11-19 CN claimed
US-20260103451-A1 PROCESS FOR PREPARING PYRIMIDINYL BIPYRIDINE COMPOUND AND INTERMEDIATE THEREFOR BEYONDBIO INC (KR) 2026-04-16 US disclosed
US-12371418-B2 Process for preparing pyrimidinyl bipyridine compound and intermediate therefor BEYONDBIO INC. (KR) 2025-07-29 US disclosed
WO-2024240242-A1 COMPOUND CONTAINING AMIDE-SUBSTITUTED AROMATIC RING, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 正大天晴药业集团股份有限公司 2024-11-28 WO disclosed
CN-114364671-B Process for preparing pyrimidinyl bipyridine compounds and intermediates therefor BEYONDBIO株式会社 2024-08-02 CN disclosed
US-20230131535-A1 ARYLMETHYLENE AROMATIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS D. E. SHAW RESEARCH, LLC 2023-04-27 US disclosed
US-20220403383-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. 2022-12-22 US disclosed
US-20220324839-A1 PROCESS FOR PREPARING PYRIMIDINYL BIPYRIDINE COMPOUND AND INTERMEDIATE THEREFOR BEYONDBIO INC. (KR) 2022-10-13 US disclosed
CN-115043773-A Synthesis method of 4-N-tert-butyloxycarbonyl-1- (3-methoxypropyl) -4-piperidinamine 山东新时代药业有限公司 2022-09-13 CN disclosed
EP-4029861-A1 METHOD FOR PRODUCING PYRIMIDINYL BIPYRIDINE COMPOUND AND INTERMEDIATE THEREFOR Beyondbio Inc. (KR) 2022-07-20 EP disclosed
EP-1919907-A2 HETEROCYCLIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-05-14 EP disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed
US-6191145-B1 ANTICOAGULANTS; ANTIINFLAMMATORY AGENTS ORTHO-MCNEIL PHARMACEUTICAL, INC. 2001-02-20 US disclosed
EP-1028943-A2 ORALLY-ACTIVE NIPECOTAMIDE GLYCOLAMIDE ESTERS FOR THE TREATMENT OF THROMBOSIS DISORDERS Ortho-Mcneil Pharmaceutical, Inc. (US) 2000-08-23 EP disclosed
US-6066651-A ANTITHROMBOTIC AGENTS BY VIRTUE OF THEIR ABILITY TO PREVENT PLATELET AGGREGATION ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2000-05-23 US disclosed
WO-1999021832-A2 ORALLY-ACTIVE NIPECOTAMIDE GLYCOLAMIDE ESTERS FOR THE TREATMENT OF THROMBOSIS DISORDERS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 1999-05-06 WO disclosed
US-5661148-A ANTIHYPOXIC AGENT FOR RESPIRATORY SYSTEM DISORDER TEIJIN LIMITED (JP) 1997-08-26 US disclosed
EP-0514540-B1 PYRROLO 2,3-d]PYRIMIDINE DERIVATIVE, PROCESS FOR PREPARING THE SAME, AND PHARMACEUTICAL PREPARATION COMPRISING THE DERIVATIVE AS ACTIVE INGREDIENT TEIJIN LTD (JP) 1996-07-17 EP disclosed
EP-0514540-A1 PYRROLO 2,3-d]PYRIMIDINE DERIVATIVE, PROCESS FOR PREPARING THE SAME, AND PHARMACEUTICAL PREPARATION COMPRISING THE DERIVATIVE AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1992-11-25 EP disclosed
US-3970656-A ANALGESIC GOVERNMENT OF THE UNITED STATES (US) 1976-07-20 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-20260103451-A1 PROCESS FOR PREPARING PYRIMIDINYL BIPYRIDINE COMPOUND AND INTERMEDIATE THEREFOR CCND1, CCND2, CDK2 GABRA1 3071/4885TSHR 2561/4885GABRG2 3054/4885
US-20220403383-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING RBM17, SF3B1, SNRPA1 GABRA1 2520/4885TSHR 4288/4885GABRG2 1919/4885
US-20220324839-A1 PROCESS FOR PREPARING PYRIMIDINYL BIPYRIDINE COMPOUND AND INTERMEDIATE THEREFOR WEE1, GGPS1, WEE2 GABRA1 393/4885TSHR 4689/4885GABRG2 471/4885
US-12371418-B2 Process for preparing pyrimidinyl bipyridine compound and intermediate therefor WEE1, GGPS1, WEE2 GABRA1 393/4885TSHR 4689/4885GABRG2 471/4885
US-20230131535-A1 ARYLMETHYLENE AROMATIC COMPOUNDS AS Kv1.3 POTASSIUM SHAKER CHANNEL BLOCKERS KCNJ2, KCNA3, KCNK3 GABRA1 374/4885TSHR 2184/4885GABRG2 555/4885

“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.