SCHEMBL24000565

SCHEMBL24000565

COc1ccc2c(-c3ccc(CN)cc3)nn(C)c(=O)c2c1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 4/20 0.65
KAT2B Q92831 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MAPK1 P28482 1/20 0.48
KDM4E B2RXH2 3/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 2/20 0.47
TP53 P04637 2/20 0.47
HPGD P15428 2/20 0.44
HRH3 Q9Y5N1 4/20 0.44
PPARG P37231 1/20 0.44
NCOA2 Q15596 1/20 0.44
NCOA1 Q15788 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NCOA3 Q9Y6Q9 1/20 0.44
MAPT P10636 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
Hydrochloric Acid SCHEMBL30088859 0.99 ENPP1 (0.64) ENPP1KAT2BSMN1; SMN2MAPK1KDM4E
SCHEMBL24000572 0.95 ENPP1 (0.71) ENPP1KAT2BSMN1; SMN2MAPK1KDM4E
Hydrochloric Acid SCHEMBL30088809 0.94 ENPP1 (0.70) ENPP1KAT2BSMN1; SMN2MAPK1KDM4E
Hydrochloric Acid SCHEMBL31384267 0.85 ENPP1 (0.68) ENPP1KAT2BSMN1; SMN2MAPK1KDM4E
SCHEMBL25547865 0.85 ENPP1 (0.53) ENPP1SMN1; SMN2KDM4EALDH1A1LMNA
Hydrochloric Acid SCHEMBL30088694 0.84 ENPP1 (0.52) ENPP1SMN1; SMN2KDM4EALDH1A1LMNA
SCHEMBL24000235 0.83 ENPP1 (0.92) ENPP1KAT2BSMN1; SMN2MAPK1KDM4E
Hydrochloric Acid SCHEMBL28917132 0.82 ENPP1 (0.64) ENPP1KAT2BSMN1; SMN2MAPK1KDM4E
SCHEMBL25546465 0.81 ENPP1 (0.49) ENPP1SMN1; SMN2MAPK1ALDH1A1LMNA
Hydrochloric Acid SCHEMBL31384331 0.81 ENPP1 (0.74) ENPP1KAT2BSMN1; SMN2MAPK1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115515939-A Novel phthalazine derivatives having an inhibitory activity on ectonucleotide pyrophosphatase-phosphodiesterase and their use 谛希诺生物科技有限公司 2022-12-23 CN claimed
US-20230159469-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLOEOTIDE PYROPHOSPHATASE/PHOSPHODIESTE RASE INHIBITORY ACTIVITY, AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2023-05-25 US disclosed
US-20230159469-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLOEOTIDE PYROPHOSPHATASE/PHOSPHODIESTE RASE INHIBITORY ACTIVITY, AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2023-05-25 US disclosed
CN-115515939-A Novel phthalazine derivatives having an inhibitory activity on ectonucleotide pyrophosphatase-phosphodiesterase and their use 谛希诺生物科技有限公司 2022-12-23 CN disclosed
WO-2021225407-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE INHIBITORY ACTIVITY, AND USE THEREOF 주식회사 티씨노바이오사이언스 (KR) 2021-11-11 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 (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-20230159469-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLOEOTIDE PYROPHOSPHATASE/PHOSPHODIESTE RASE INHIBITORY ACTIVITY, AND USE THEREOF ENPP1, ENPP3, PPA1 ENPP1 1/4885KAT2B 3850/4885SMN1; SMN2 3741/4885

“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.