SCHEMBL322380

SCHEMBL322380

CC(C(=O)O)C(=O)C1CC1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.36
SLC7A5 Q01650 1/20 0.31
ALDH1A1 P00352 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL17351371 0.90 CES2 (0.40) TP53ALDH1A1SMN1; SMN2
SCHEMBL391673 0.90 RECQL (0.38) TP53ALDH1A1SMN1; SMN2
SCHEMBL3495827 0.88 CES2 (0.44) ALDH1A1SMN1; SMN2
SCHEMBL14946416 0.79 CA2 (0.31)
SCHEMBL16160349 0.77
SCHEMBL21100159 0.75 MAPT (0.33) ALDH1A1
SCHEMBL800709 0.75
SCHEMBL21099805 0.75 MAPT (0.33) ALDH1A1
SCHEMBL13197315 0.75 MAPT (0.33) ALDH1A1
SCHEMBL11714520 0.74 CES2 (0.50) ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6441176-B1 N-(5-CYCLOPROPYL-1-QUINOLIN-5-YL-1H-PYRAZOLE-4-CARBONYL) -GUANIDINE; REACTING QUINOLIN-5-YL-HYDRAZINE AND METHYL-3-CYCLOPROPYL-2-DIMETHYLENAMINO-3-OXOPROPANOATE, HYDROYLZING, FORMING ACYLHALIDE AND FURTHER REACTING WITH GUANIDINE PFIZER INC. 2002-08-27 US claimed
EP-1101763-A2 Method for preparing sodium-hydrogen exchanger type 1 inhibitor Pfizer Products Inc. (US) 2001-05-23 EP claimed
US-20230400766-A1 ONIUM SALT, RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-12-14 US disclosed
CN-106986869-A Compounds and methods for for antiviral therapy 吉利德科学公司 2017-07-28 CN disclosed
EP-2298747-B1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2016-12-28 EP disclosed
CN-104583211-A Compounds and methods for antiviral therapy GILEAD SCIENCES INC 2015-04-29 CN disclosed
CN-104327062-A Cyclic Inhibitors of 11Beta-Hydroxysteroid Dehydrogenase 1 BOEHRINGER INGELHEIM INT 2015-02-04 CN disclosed
EP-2708539-A1 Annulated pyrimidines and triazines and their use Bayer Intellectual Property GmbH (DE) 2014-03-19 EP disclosed
EP-2682394-A1 1H-pyrazolo[3,4-b]pyridin-triazine derivatives and their use for the treatment or the prevention of cardiovascular diseases Bayer Intellectual Property GmbH (DE) 2014-01-08 EP disclosed
EP-2590979-A1 RING-FUSED PYRIMIDINES AND TRIAZINES AND USE THEREOF FOR THE TREATMENT AND/OR PROPHYLAXIS OF CARDIOVASCULAR DISEASES Bayer Intellectual Property GmbH (DE) 2013-05-15 EP disclosed
US-8202868-B2 4-piperazinyl-pyrimidine compounds suitable for treating disorders that respond to modulation of the dopamine D3 receptor ABBOTT GMBH & CO. KG (DE) 2012-06-19 US disclosed
US-20020065283-A1 Heteroarylcarboxamide compounds active against protein tyrosine kinase related disorders MCMAHON GERALD (US) 2002-05-30 US disclosed
EP-1012150-A4 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS SUGEN INC (US) 2002-05-29 EP disclosed
US-6316479-B1 ANTICANCER AGENTS SUGEN, INC. 2001-11-13 US disclosed
EP-1101763-A2 Method for preparing sodium-hydrogen exchanger type 1 inhibitor Pfizer Products Inc. (US) 2001-05-23 EP disclosed
WO-2001030759-A2 SODIUM-HYDROGEN EXCHANGER TYPE 1 INHIBITOR CRYSTALS PFIZER PRODUCTS INC. (US) 2001-05-03 WO disclosed
EP-1012150-A1 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS Sugen, Inc. (US) 2000-06-28 EP disclosed
WO-1998052944-A1 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS SUGEN, INC. (US) 1998-11-26 WO disclosed
US-4588711-A Insecticidal phosphorus derivatives of 6-cycloalkyl-4-pyrimidinols THE DOW CHEMICAL COMPANY (US) 1986-05-13 US disclosed
US-4489068-A Method and composition for enhancing the insecticidal activity of certain organophosphorus compounds THE DOW CHEMICAL COMPANY (US) 1984-12-18 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 (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-20020065283-A1 Heteroarylcarboxamide compounds active against protein tyrosine kinase related disorders ABL1, ERBB2, PRKDC TP53 862/4885SLC7A5 2748/4885ALDH1A1 3956/4885

“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.