SCHEMBL509567

SCHEMBL509567

Cc1cc(O)cc(C#N)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
TTR P02766 2/20 0.48
ALB P02768 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP2A6 P11509 1/20 0.42
CA12 O43570 1/20 0.42
CA2 P00918 1/20 0.42
CA3 P07451 1/20 0.42
CA6 P23280 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
ACHE P22303 2/20 0.40
HCAR1 Q9BXC0 1/20 0.40
SELL P14151 1/20 0.40
SELP P16109 1/20 0.40
SELE P16581 1/20 0.40
XDH P47989 1/20 0.39
MMP3 P08254 1/20 0.38
GRM5 P41594 2/20 0.36

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
SCHEMBL29450984 1.00 ALDH1A1 (0.55) ALDH1A1TTRALBMEN1KMT2A
SCHEMBL501406 0.82 ALDH1A1 (0.52) ALDH1A1TTRALBMEN1KMT2A
SCHEMBL214163 0.82 CA12 (0.52) TTRALBMEN1KMT2ACA12
SCHEMBL509092 0.82 CA12 (0.52) ALDH1A1TTRALBMEN1KMT2A
SCHEMBL1004620 0.82 ALDH1A1 (0.52) ALDH1A1TTRALBMEN1KMT2A
SCHEMBL9264989 0.82 CA12 (0.52) TTRALBMEN1KMT2ACA12
Phenol SCHEMBL28330144 0.79 CA12 (0.46) ALDH1A1TTRALBMEN1KMT2A
SCHEMBL12535886 0.78 ALDH1A1 (0.57) ALDH1A1MEN1KMT2AACHEHCAR1
Orcinol SCHEMBL17085568 0.77 ALDH1A1 (0.63) ALDH1A1MEN1KMT2ACA12CA2
SCHEMBL7039619 0.76 ALDH1A1 (0.55) ALDH1A1MEN1KMT2ACA2ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4630420-A1 INHIBITORS OF NLRP3 F. Hoffmann-La Roche AG (CH) 2025-10-15 EP claimed
EP-4419532-A1 FUSED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS NLRP3 INHIBITORS F. Hoffmann-La Roche AG (CH) 2024-08-28 EP claimed
US-20240279237-A1 FUSED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS NLRP3 INHIBITORS HOFFMANN-LA ROCHE INC. (US) 2024-08-22 US claimed
WO-2024121184-A1 INHIBITORS OF NLRP3 F. HOFFMANN-LA ROCHE AG (CH) 2024-06-13 WO claimed
WO-2023066825-A1 FUSED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS NLRP3 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-04-27 WO claimed
EP-4630420-A1 INHIBITORS OF NLRP3 F. Hoffmann-La Roche AG (CH) 2025-10-15 EP disclosed
CN-116283658-B Hydrazide hydrazone HIF-2 alpha inhibitor and application thereof 浙江大学医学院附属第一医院 2025-04-25 CN disclosed
US-12258329-B2 Pyrimidone derivatives as selective cytotoxic agents against HIV infected cells MERCK SHARP & DOHME LLC (US) 2025-03-25 US disclosed
WO-2024218100-A1 OXAZOLO[4,5-B]PYRAZINE AND OXAZOLO[4,5-B]PYRIDINE DERIVATIVES AS NLRP3 INHIBITORS FOR THE TREATMENT OF E.G. INFLAMMATORY DISEASES F. HOFFMANN-LA ROCHE AG (CH) 2024-10-24 WO disclosed
EP-4433459-A1 PYRIDAZINE DERIVATIVES AS INHIBITORS OF NLRP3 F. Hoffmann-La Roche AG (CH) 2024-09-25 EP disclosed
US-12077506-B2 Indane derivatives as hypoxia inducible factor-2(α) inhibitors NIKANG THERAPEUTICS, INC. (US) 2024-09-03 US disclosed
EP-4419532-A1 FUSED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS NLRP3 INHIBITORS F. Hoffmann-La Roche AG (CH) 2024-08-28 EP disclosed
EP-1377556-A1 PYRAZOLE DERIVATIVES FOR TREATING HIV Pfizer Limited (GB) 2004-01-07 EP disclosed
US-20030100554-A1 Pyrazole derivatives JONES LYN HOWARD (GB) 2003-05-29 US disclosed
EP-1267874-A2 THERAPEUTIC USES OF PPAR MEDIATORS Aventis Pharma Deutschland GmbH (DE) 2003-01-02 EP disclosed
WO-2002085860-A1 PYRAZOLE DERIVATIVES FOR TREATING HIV PFIZER LIMITED (GB) 2002-10-31 WO disclosed
US-6376512-B1 FOR TREATING PHYSIOLOGICAL CONDITION IN PATIENT WHEREIN SAID CONDITION IS ASSOCIATED WITH A PHYSIOLOGICALLY DETRIMENTAL LEVELS OF INSULIN, GLUCOSE, FREE FATTY ACIDS, OR TRIGLYCERIDES AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-23 US disclosed
WO-2001066098-A2 THERAPEUTIC USES OF PPAR MEDIATORS AVENTIS PHARMA DEUTSCHLAND GMBH 2001-09-13 WO disclosed
US-5059610-A QUINOLINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF LEUKOTRIENE D4 RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1991-10-22 US disclosed
US-4920132-A Quinoline derivatives and use thereof as antagonists of leukotriene D4 RORER PHARMACEUTICAL CORP. (US) 1990-04-24 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 (4 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-12077506-B2 Indane derivatives as hypoxia inducible factor-2(α) inhibitors HIF1AN, HIF1A, NFE2L2 ALDH1A1 642/4885TTR 4745/4885ALB 4113/4885
US-12258329-B2 Pyrimidone derivatives as selective cytotoxic agents against HIV infected cells TYMP, PNP, CD4 ALDH1A1 2371/4885TTR 2015/4885ALB 4437/4885
US-20030100554-A1 Pyrazole derivatives REV1, SARS1, CYP2F1 ALDH1A1 385/4885TTR 1407/4885ALB 3317/4885
US-20240279237-A1 FUSED BICYCLIC HETEROARYL COMPOUNDS USEFUL AS NLRP3 INHIBITORS NLRP3, NOD1, NLRP1 ALDH1A1 2364/4885TTR 4754/4885ALB 4809/4885

“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.