SCHEMBL25547865

SCHEMBL25547865

COc1cc2c(-c3ccc(CN)cc3)nn(C)c(=O)c2cc1OC

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 7/20 0.53
KDM4E B2RXH2 5/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
HPGD P15428 3/20 0.45
HTT P42858 1/20 0.45
PKM P14618 1/20 0.45
TSHR P16473 1/20 0.45
MAPT P10636 3/20 0.45
KMT2A Q03164 1/20 0.45
NPSR1 Q6W5P4 3/20 0.44
LMNA P02545 1/20 0.44
CHEK1 O14757 1/20 0.44
ALDH1A1 P00352 2/20 0.43
TP53 P04637 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
Hydrochloric Acid SCHEMBL30088694 0.99 ENPP1 (0.52) ENPP1KDM4ESMN1; SMN2HPGDHTT
SCHEMBL25546465 0.85 ENPP1 (0.49) ENPP1SMN1; SMN2HPGDHTTMAPT
SCHEMBL24000565 0.85 ENPP1 (0.65) ENPP1KDM4ESMN1; SMN2HPGDMAPT
SCHEMBL24000572 0.85 ENPP1 (0.71) ENPP1KDM4ESMN1; SMN2HPGDMAPT
Hydrochloric Acid SCHEMBL31384250 0.84 ENPP1 (0.56) ENPP1KDM4ESMN1; SMN2HPGDHTT
Hydrochloric Acid SCHEMBL30088859 0.84 ENPP1 (0.64) ENPP1KDM4ESMN1; SMN2HPGDMAPT
Hydrochloric Acid SCHEMBL30088809 0.84 ENPP1 (0.70) ENPP1KDM4ESMN1; SMN2HPGDMAPT
SCHEMBL7682628 0.81 MAPT (0.46) ENPP1KDM4ESMN1; SMN2HPGDHTT
Hydrochloric Acid SCHEMBL28917135 0.81 ENPP1 (0.53) ENPP1KDM4ESMN1; SMN2HPGDHTT
SCHEMBL24000525 0.80 ENPP1 (0.68) ENPP1SMN1; SMN2HPGDHTTKMT2A

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 3 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
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

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 1/4885KDM4E 2943/4885SMN1; 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.