SCHEMBL24392620

SCHEMBL24392620

Cc1cc(F)n2ncnc(O)c12

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.33
▸ EGFR P00533 1/20 0.32
▸ KDR P35968 1/20 0.32
▸ EGLN2 Q96KS0 7/20 0.32
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ ENPP1 P22413 1/20 0.30

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
SCHEMBL24392666 0.82 ALDH1A1 (0.33) ALDH1A1EGFRKDRKDM4EPKM
SCHEMBL24392462 0.81 ALDH1A1 (0.43) ALDH1A1EGFRKDRKDM4EPKM
SCHEMBL24393049 0.81 ALDH1A1 (0.35) ALDH1A1EGLN2ALOX15TSHRMAPK1
SCHEMBL24392619 0.79 EGLN2 (0.35) ALDH1A1EGFRKDREGLN2ALOX15
SCHEMBL24393338 0.79 ALDH1A1 (0.33) ALDH1A1EGFRKDRKDM4EPKM
SCHEMBL24391780 0.76 ACVRL1 (0.33) ALDH1A1EGLN2ALOX15TSHRMAPK1
SCHEMBL24391967 0.75 EGLN2 (0.37) EGLN2
SCHEMBL24392206 0.66 ALDH1A1 (0.31) ALDH1A1KDM4E
SCHEMBL24392052 0.63 ALDH1A1 (0.35) ALDH1A1EGLN2KDM4EPKMENPP1
SCHEMBL24393212 0.63 ALDH1A1 (0.35) ALDH1A1EGLN2TSHRKDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022091048-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2022-05-05 — — WO disclosed
US-20220135598-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2022-05-05 — — 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 (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-20220135598-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, ENPP2 ALDH1A1 754/4885EGFR 4503/4885KDR 4141/4885

“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.

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