SCHEMBL3328767

SCHEMBL3328767

CCOC(=O)c1cc(O)c2ccc(Cl)cc2n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GABRA2 P47869 5/20 0.46
GABRB2 P47870 5/20 0.46
CYP1A2 P05177 1/20 0.45
ALOX15 P16050 4/20 0.45
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
ADORA2A P29274 1/20 0.44
KMT2A Q03164 1/20 0.43

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
SCHEMBL31167429 1.00 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2GABRA2GABRB2CYP1A2
SCHEMBL3332188 0.86 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2CYP1A2KDM4EMAPT
SCHEMBL2904899 0.85 EGFR (0.46) KMT2A
SCHEMBL3336367 0.83 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2GABRA2GABRB2CYP1A2
SCHEMBL30002312 0.82 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2GABRA2GABRB2CYP1A2
SCHEMBL1733527 0.82 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2GABRA2GABRB2CYP1A2
SCHEMBL3330035 0.81 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2GABRA2GABRB2CYP1A2
SCHEMBL164778 0.81 KMT2A (0.50) SMN1; SMN2ALOX15KDM4EMAPTADORA2A
SCHEMBL3331633 0.81 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2CYP1A2KDM4EHPGD
SCHEMBL4470516 0.81 KDM4E (0.46) ALDH1A1SMN1; SMN2CYP1A2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10870633-B2 Types of C-3 substituted kynurenic acid derivatives with improved neuroprotective activity Szegedi Tudományegyetem (HU) 2020-12-22 US disclosed
EP-3423444-B1 NOVEL TYPES OF C-3 SUBSTITUTED KINURENIC ACID DERIVATIVES WITH IMPROVED NEUROPROTECTIVE ACTIVITY UNIV SZEGEDI (HU) 2020-11-18 EP disclosed
US-20190106409-A1 NOVEL TYPES OF C-3 SUBSTITUTED KYNURENIC ACID DERIVATIVES WITH IMPROVED NEUROPROTECTIVE ACTIVITY Szegedi Tudományegyetem (HU) 2019-04-11 US disclosed
EP-3423444-A1 NOVEL TYPES OF C-3 SUBSTITUTED KINURENIC ACID DERIVATIVES WITH IMPROVED NEUROPROTECTIVE ACTIVITY Szegedi Tudományegyetem (HU) 2019-01-09 EP disclosed
US-8669266-B2 Quinoline-carboxamide derivatives as P2Y12 antagonists SANOFI (FR) 2014-03-11 US disclosed
US-20100135999-A1 QUINOLINE-CARBOXAMIDE DERIVATIVES AS P2Y12 ANTAGONISTS SANOFI-AVENTIS (FR) 2010-06-03 US disclosed
EP-2148871-A1 QUINOLINE-CARBOXAMIDE DERIVATIVES AS P2Y12 ANTAGONISTS Sanofi-Aventis (FR) 2010-02-03 EP disclosed
WO-2008128647-A1 QUINOLINE-CARBOXAMIDE DERIVATIVES AS P2Y12 ANTAGONISTS SANOFI-AVENTIS (FR) 2008-10-30 WO 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-20100135999-A1 QUINOLINE-CARBOXAMIDE DERIVATIVES AS P2Y12 ANTAGONISTS P2RY12, P2RY1, P2RY2 ALDH1A1 2297/4885SMN1; SMN2 4406/4885GABRA2 639/4885
US-20190106409-A1 NOVEL TYPES OF C-3 SUBSTITUTED KYNURENIC ACID DERIVATIVES WITH IMPROVED NEUROPROTECTIVE ACTIVITY KYNU, KMO, PARK7 ALDH1A1 2827/4885SMN1; SMN2 439/4885GABRA2 590/4885
US-10870633-B2 Types of C-3 substituted kynurenic acid derivatives with improved neuroprotective activity KYNU, KMO, PARK7 ALDH1A1 2924/4885SMN1; SMN2 527/4885GABRA2 637/4885

“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.