SCHEMBL1037055

SCHEMBL1037055

CCNCc1ccc(C#N)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.67
CYP2A6 P11509 2/20 0.59
SCN8A Q9UQD0 1/20 0.49
CYP19A1 P11511 3/20 0.49
CACNA1G O43497 1/20 0.48
CACNA1B Q00975 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
CA9 Q16790 1/20 0.47
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
EPHX2 P34913 1/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 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
SCHEMBL23879203 0.87 LOXL2 (0.71) LOXL2CYP2A6SCN8ACYP19A1CACNA1G
SCHEMBL15831741 0.84 LOXL2 (0.62) LOXL2CYP2A6SCN8ACYP19A1CACNA1G
SCHEMBL29912750 0.83 LOXL2 (0.65) LOXL2CYP2A6SCN8ACYP19A1CACNA1G
SCHEMBL9180552 0.82 LMNA (0.52) ALDH1A1KDM4ECYP1A2CYP2D6CYP2C19
SCHEMBL2828109 0.81 SCN8A (0.58) LOXL2CYP2A6SCN8ACYP19A1CACNA1G
SCHEMBL509578 0.80 LOXL2 (1.00) LOXL2CYP2A6SCN8ACYP19A1CACNA1G
SCHEMBL26148107 0.80 CYP2A6 (0.55) LOXL2CYP2A6SCN8ACYP19A1CA12
SCHEMBL8897410 0.79 LOXL2 (0.61) LOXL2CYP2A6SCN8ACYP19A1CACNA1G
SCHEMBL6353289 0.79 LOXL2 (0.61) LOXL2CYP2A6SCN8ACYP19A1CACNA1G
SCHEMBL7050164 0.79 LOXL2 (0.61) LOXL2CYP2A6SCN8ACYP19A1CACNA1G

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-20250338848-A1 FUNGICIDAL COMPOSITIONS SYNGENTA CROP PROTECTION AG (CH) 2025-11-06 US disclosed
US-12441704-B2 Compounds active towards nuclear receptors NUEVOLUTION A/S (DK) 2025-10-14 US disclosed
US-20240284908-A1 Fungicidal Compositions SYNGENTA PARTICIPATIONS AG (CH) 2024-08-29 US disclosed
US-11974572-B2 Fungicidal compositions SYGENTA PARTICIPATIONS AG (CH) 2024-05-07 US disclosed
US-11780843-B2 Compounds active towards nuclear receptors NUEVOLUTION A/S (DK) 2023-10-10 US disclosed
US-11780843-B2 Compounds active towards nuclear receptors NUEVOLUTION A/S (DK) 2023-10-10 US disclosed
US-20230271937-A1 COMPOUNDS ACTIVE TOWARDS NUCLEAR RECEPTORS NUEVOLUTION A/S (DK) 2023-08-31 US disclosed
US-20230271937-A1 COMPOUNDS ACTIVE TOWARDS NUCLEAR RECEPTORS NUEVOLUTION A/S (DK) 2023-08-31 US disclosed
US-20230271937-A1 COMPOUNDS ACTIVE TOWARDS NUCLEAR RECEPTORS NUEVOLUTION A/S (DK) 2023-08-31 US disclosed
US-11685727-B2 Compounds active towards nuclear receptors NUEVOLUTION A/S (DK) 2023-06-27 US disclosed
US-7279578-B2 Sulfonylamino-acetic acid derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2007-10-09 US disclosed
US-7279578-B2 Sulfonylamino-acetic acid derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2007-10-09 US disclosed
US-7279578-B2 Sulfonylamino-acetic acid derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2007-10-09 US disclosed
CN-1332942-C Sulfonylamino-acetic acid derivatives and their use as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD (CH) 2007-08-22 CN disclosed
US-20060014783-A1 Sulfonylamino-acetic acid derivatives ACTELION PHARMACEUTICALS, LTD. (CH) 2006-01-19 US disclosed
CN-1703397-A Sulfonylamino-acetic acid derivatives and their use as orexin receptor antagonists ACTELION PHARMACEUTICALS LTD (CH) 2005-11-30 CN disclosed
EP-1554239-A2 SULFONYLAMINO-ACETIC ACID DERIVATIVES AND THEIR USE AS OREXIN RECEPTOR ANTAGONISTS Actelion Pharmaceuticals Ltd. (CH) 2005-07-20 EP disclosed
WO-2004033418-A2 SULFONYLAMINO-ACETIC DERIVATIVES AND THEIR USE AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2004-04-22 WO disclosed
WO-2004033418-A2 SULFONYLAMINO-ACETIC DERIVATIVES AND THEIR USE AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2004-04-22 WO disclosed
US-20030004308-A1 Novel thrombin inhibitors, the preparation and use thereof BOHM HANS-JOACHIM (DE) 2003-01-02 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 (9 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-20240284908-A1 Fungicidal Compositions CYP51A1, CYP4X1, CYP1B1 LOXL2 1993/4885CYP2A6 139/4885SCN8A 3774/4885
US-20250338848-A1 FUNGICIDAL COMPOSITIONS CYP3A7, DHCR7, CASP7 LOXL2 4404/4885CYP2A6 18/4885SCN8A 630/4885
US-20060014783-A1 Sulfonylamino-acetic acid derivatives HCRTR2, HCRTR1, GIPR LOXL2 4004/4885CYP2A6 1084/4885SCN8A 1322/4885
US-11780843-B2 Compounds active towards nuclear receptors NCOA1, NR1H2, NCOA3 LOXL2 3242/4885CYP2A6 559/4885SCN8A 2603/4885
US-11685727-B2 Compounds active towards nuclear receptors NCOA1, NR1H2, NCOA3 LOXL2 3242/4885CYP2A6 559/4885SCN8A 2603/4885
US-20230271937-A1 COMPOUNDS ACTIVE TOWARDS NUCLEAR RECEPTORS NCOA1, NR1H2, NCOA3 LOXL2 3242/4885CYP2A6 559/4885SCN8A 2603/4885
US-11974572-B2 Fungicidal compositions CYP51A1, CYP4X1, CYP1B1 LOXL2 1993/4885CYP2A6 139/4885SCN8A 3774/4885
US-12441704-B2 Compounds active towards nuclear receptors NCOA1, NR1H2, NCOA3 LOXL2 3242/4885CYP2A6 559/4885SCN8A 2603/4885
US-20030004308-A1 Novel thrombin inhibitors, the preparation and use thereof TFPI, SERPINC1, F2 LOXL2 2231/4885CYP2A6 706/4885SCN8A 3714/4885

“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.