SCHEMBL42600

SCHEMBL42600

c1ccc(CC2CC[N]CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.59
CCR3 P51677 3/20 0.53
PRMT3 O60678 1/20 0.49
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
PRMT1 Q99873 1/20 0.49
PRMT8 Q9NR22 1/20 0.49
GRIN2B Q13224 2/20 0.47
MGLL Q99685 1/20 0.47
TSHR P16473 1/20 0.46
SIGMAR1 Q99720 2/20 0.46
ALDH1A1 P00352 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
SCHEMBL1366152 0.88 GBA1 (0.50) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL2027845 0.84 GBA1 (0.71) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL674276 0.84 GBA1 (0.71) GBA1CCR3PRMT3CARM1PRMT6
Ammonia Solution, Strong SCHEMBL1432566 0.81 GBA1 (0.68) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL8776715 0.81 CCR3 (0.57) CCR3PRMT3CARM1PRMT6PRMT1
Hydrochloric Acid SCHEMBL4797146 0.79 GBA1 (0.65) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL8701 0.79 GBA1 (0.65) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL316482 0.79 GBA1 (0.65) GBA1CCR3PRMT3CARM1PRMT6
SCHEMBL240002 0.79 MAOA (0.50) CARM1PRMT6
SCHEMBL3130172 0.79 ALDH1A1 (0.51) CCR3GRIN2BTSHRALDH1A1

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 1274 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118047726-A Ferulic acid ester analogues, preparation method and application thereof 西北大学 2024-05-17 CN claimed
CN-117946031-A Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors 北京大学 2024-04-30 CN claimed
US-20240018119-A1 CARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING MENTAL ILLNESS TRINEURO (KR) 2024-01-18 US claimed
US-20230212144-A1 5-MEMBERED HETEROARYL DERIVATIVE CONTAINING AT LEAST ONE N, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING MENTAL DISORDERS, CONTAINING SAME AS ACTIVE INGREDIENT TRINEURO (KR) 2023-07-06 US claimed
CN-113773289-B Naphthalene [1,2-b ] heterocycle-4, 5-diketone compound and preparation method and application thereof 沈阳药科大学 2023-05-12 CN claimed
CN-116057049-A Carboxamide derivatives and pharmaceutical composition for preventing or treating mental diseases containing the same as active ingredient 大邱庆北尖端医疗产业振兴财团 2023-05-02 CN claimed
CN-116057053-A 5-membered heteroaryl derivatives containing at least one N and pharmaceutical compositions containing the same as active ingredient for preventing or treating mental disorders 大邱庆北尖端医疗产业振兴财团 2023-05-02 CN claimed
CN-114315689-B Disulfanylphthalimide compound, preparation method and application thereof 四川大学 2023-04-07 CN claimed
CN-114805367-B Triazole pyrimidine derivative and preparation method and application thereof 郑州大学 2023-04-07 CN claimed
WO-2023001268-A1 CHRYSIN DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 深圳枫语生物医药科技有限公司 2023-01-26 WO claimed
US-4576943-A NERVOUS SYSTEM DISORDERS, SEDATIVES, HYPOTENSIVE AGENTS AMERICAN CYANAMID COMPANY (US) 1986-03-18 US claimed
US-4569994-A Dibenzo[b,d]pyranyloxyaminopropanols PENNWALT CORPORATION 1986-02-11 US claimed
EP-0155809-A2 Renin inhibitors containing statine or derivatives thereof PFIZER INC. (US) 1985-09-25 EP claimed
EP-0039051-B1 MANNICH-BASE HYDROXAMIC ACID PRODRUGS FOR THE IMPROVED BIOAVAILABILITY OF NON-STEROIDAL ANTI-INFLAMMATORY AGENTS, A PROCESS FOR PREPARING AND A PHARMACEUTICAL COMPOSITION CONTAINING THEM MERCK & CO. INC. (US) 1985-07-24 EP claimed
US-4412994-A AMINE COMPOUNDS CONTAINING THE ACYL RESIDUE OF INDOMETHACIN AS A SUBSTITUENT INTERX RESEARCH CORPORATION (US) 1983-11-01 US claimed
EP-0051278-A1 Soft tertiary amine esters of bio-affecting carboxylic acids, processes for preparing and a pharmaceutical composition containing the same MERCK & CO. INC. (US) 1982-05-12 EP claimed
WO-1982001186-A1 NOVEL BENZOXAZOLINONES,SUBSTITUTED IN THE 6-POSITION BY AN AMINOALCOHOL CHAIN OR AMINO-KETONE CHAIN,THEIR PREPARATION AND THEIR USE IN PHARMACEUTICAL PREPARATIONS BUSCH N 1982-04-15 WO claimed
EP-0039051-A2 Mannich-base hydroxamic acid prodrugs for the improved bioavailability of non-steroidal anti-inflammatory agents, a process for preparing and a pharmaceutical composition containing them MERCK & CO. INC. (US) 1981-11-04 EP claimed
EP-0007067-A1 Phenylpiperidine derivatives, processes for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1980-01-23 EP claimed
US-4139626-A FUNGICIDES SYNTEX (U.S.A.) INC. (US) 1979-02-13 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20240018119-A1 CARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING MENTAL ILLNESS MAOA, DRD2, MAOB GBA1 1662/4885CCR3 4856/4885PRMT3 1595/4885
US-20230212144-A1 5-MEMBERED HETEROARYL DERIVATIVE CONTAINING AT LEAST ONE N, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING MENTAL DISORDERS, CONTAINING SAME AS ACTIVE INGREDIENT HTR5A, HTR2C, TPH1 GBA1 2395/4885CCR3 4875/4885PRMT3 2338/4885

“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.