SCHEMBL16624282

SCHEMBL16624282

COCc1nc(O)c(C#N)cc1C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.52
RXFP1 Q9HBX9 2/20 0.52
MAPT P10636 1/20 0.52
GAA P10253 1/20 0.50
LMNA P02545 1/20 0.46
ALDH1A1 P00352 6/20 0.44
HPGD P15428 5/20 0.44
CRHBP P24387 2/20 0.44
CRHR2 Q13324 2/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
TDP1 Q9NUW8 1/20 0.43
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.41

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
SCHEMBL16616148 0.87 GAA (0.51) KDM4ERXFP1MAPTGAALMNA
SCHEMBL16624267 0.82 NPC1 (0.48) KDM4ERXFP1MAPTGAALMNA
SCHEMBL2229192 0.80 GAA (0.71) KDM4EGAALMNAALDH1A1HPGD
SCHEMBL18822821 0.74 GAA (0.62) KDM4ERXFP1MAPTGAALMNA
SCHEMBL16624279 0.72 NPC1 (0.47) KDM4ERXFP1MAPTGAAALDH1A1
SCHEMBL4740681 0.70 KDM4E (0.52) KDM4ERXFP1MAPTGAALMNA
SCHEMBL10254012 0.70 KDM4E (0.62) KDM4ERXFP1MAPTGAALMNA
SCHEMBL4740594 0.69 KDM4E (0.50) KDM4ERXFP1MAPTGAALMNA
SCHEMBL16616673 0.69 KDM4E (0.72) KDM4ERXFP1MAPTGAALMNA
SCHEMBL25256914 0.68 CA12 (0.61) KDM4ERXFP1MAPTGAALMNA

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240217950-A1 PESTICIDALLY ACTIVE CYCLIC AMINE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-07-04 US disclosed
US-20240217950-A1 PESTICIDALLY ACTIVE CYCLIC AMINE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-07-04 US disclosed
US-20240217950-A1 PESTICIDALLY ACTIVE CYCLIC AMINE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2024-07-04 US disclosed
EP-4313966-A1 PESTICIDALLY ACTIVE CYCLIC AMINE COMPOUNDS Syngenta Crop Protection AG (CH) 2024-02-07 EP disclosed
CN-117157287-A Pesticidally active cyclic amine compounds 先正达农作物保护股份公司 2023-12-01 CN disclosed
WO-2022207462-A1 PESTICIDALLY ACTIVE CYCLIC AMINE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-10-06 WO disclosed
US-9751878-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-09-05 US disclosed
US-9751878-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-09-05 US disclosed
US-20160237087-A1 HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-18 US disclosed
US-20160237087-A1 HETEROCYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-18 US disclosed
US-9353108-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-05-31 US disclosed
US-9353108-B2 Tetrahydronaphthyridine somatostatin receptor 5 antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-05-31 US disclosed
US-20150099777-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-09 US disclosed
US-20150099777-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-09 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 (3 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-20240217950-A1 PESTICIDALLY ACTIVE CYCLIC AMINE COMPOUNDS DDT, ACHE, PNMT KDM4E 2283/4885RXFP1 1633/4885MAPT 225/4885
US-20150099777-A1 HETEROCYCLIC COMPOUND SSTR5, SSTR4, SSTR2 KDM4E 3637/4885RXFP1 86/4885MAPT 3648/4885
US-20160237087-A1 HETEROCYCLIC COMPOUNDS SSTR5, SSTR4, SSTR2 KDM4E 3670/4885RXFP1 86/4885MAPT 3598/4885

“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.