SCHEMBL41501

SCHEMBL41501

c1ccc(CN2CC[N]CC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.71
MC4R P32245 1/20 0.59
DRD4 P21917 1/20 0.57
LMNA P02545 1/20 0.57
POLB P06746 1/20 0.57
ACHE P22303 1/20 0.55
CCR3 P51677 2/20 0.53
CYP3A4 P08684 1/20 0.53
HSD17B10 Q99714 1/20 0.53
KMT2A Q03164 1/20 0.52

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
SCHEMBL42218 0.92 SIGMAR1 (0.61) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL10705671 0.88 ALDH1A1 (0.59) SIGMAR1LMNAPOLBKMT2A
SCHEMBL5535229 0.88 SIGMAR1 (0.59) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1111888 0.84 DRD4 (0.53) SIGMAR1DRD4
SCHEMBL1041303 0.84 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL8188324 0.84 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL1415730 0.84 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL576868 0.84 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL2489199 0.84 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB
SCHEMBL242970 0.84 SIGMAR1 (1.00) SIGMAR1MC4RDRD4LMNAPOLB

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 1947 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410577-B1 None US claimed
US-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY AZEVAN PHARMACEUTICALS, INC. (US) 2024-04-11 US claimed
CN-117838699-A Use of disubstituted purines for anti-inflammatory 北京大学 2024-04-09 CN claimed
CN-117229268-A Hydrazide-containing nuclear transport modulators and uses thereof 卡尔约药物治疗公司 2023-12-15 CN claimed
CN-114478451-B 6- (hydroxybenzyloxy) phthalein mannich base compound, preparation method and application thereof 四川大学 2023-12-05 CN claimed
CN-117143028-A Hydroxyphenyl pyridazine Mannich base compound, and preparation method and application thereof 四川大学 2023-12-01 CN claimed
CN-110372672-B Hydrazide-containing nuclear transport modulators and uses thereof 卡尔约药物治疗公司 2023-09-29 CN claimed
CN-112300145-B Tri-aromatic ring compound targeting STAT3 bifunctional phosphorylation site and application thereof 上海宇耀生物科技有限公司 2023-07-21 CN claimed
CN-114805263-B 3- (hydroxybenzyl) phthalide compound, preparation method and application thereof 四川大学 2023-05-05 CN claimed
CN-114315689-B Disulfanylphthalimide compound, preparation method and application thereof 四川大学 2023-04-07 CN claimed
US-4342762-A USEFUL AS TRANQUILIZERS, ANALGESICS, ANTIEPILEPTIC AGENTS, AND AS A TREATMENT FOR PARKINSON'S DISEASE EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-08-03 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
US-4324786-A SEDATIVES, ANALGESICS, ANTIINFLAMMATORY, ANTIPYRETIC EGYT GYOGYSZERVEGYESZETI GYAR (HU) 1982-04-13 US claimed
US-4322418-A PROMOTION OF BLOOD CIRCULATION C. H. BOEHRINGER SOHN (DE) 1982-03-30 US 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
US-4279905-A GASTROINTESTINAL DISORDERS KALI-CHEMIE PHARMA GMBH (DE) 1981-07-21 US claimed
EP-0025109-A2 1-Benzoxepin-5(2H)-one derivatives and their salts, and processes for their preparation Kali-Chemie Pharma GmbH (DE) 1981-03-18 EP claimed
US-4128643-A 4-Quinazolinyl-guanidines HOECHST AKTIENGESELLSCHAFT (DE) 1978-12-05 US claimed
US-4059584-A ANTIINFLAMMATORY PFIZER (US) 1977-11-22 US claimed
US-4002623-A Anti-inflammatory 1-[3-(dialkylamino)propyl]-2-acylaminobenzimidazoles and 2-acylamino-3-[3-(dialkylamino)-propyl]imidazo[4,5-b]pyridines PFIZER INC. (US) 1977-01-11 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 (1 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-20240115553-A1 COMPOSITIONS AND METHODS FOR TREATING BRAIN INJURY FABP7, PYGB, CHAT SIGMAR1 3525/4885MC4R 3880/4885DRD4 3989/4885

“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.