SCHEMBL17670362

SCHEMBL17670362

Cc1cc(C(=O)O)cc(CNCc2nncn2CCc2cc(Cl)cc(Cl)c2)n1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ YTHDC1 Q96MU7 1/20 0.34
▸ MMP13 P45452 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ AURKA O14965 1/20 0.30
▸ MMP2 P08253 1/20 0.30
▸ MMP10 P09238 1/20 0.30
▸ MMP9 P14780 1/20 0.30
▸ PRKACA P17612 1/20 0.30
▸ DRD5 P21918 1/20 0.30
▸ MAPKAPK2 P49137 1/20 0.30
▸ MMP14 P50281 1/20 0.30
▸ PRKAA1 Q13131 1/20 0.30
▸ TPMT P51580 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ SMN1; SMN2 Q16637 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
SCHEMBL17670506 0.91 KDM4C (0.40) MEN1KMT2AALDH1A1
SCHEMBL17670430 0.89 YTHDC1 (0.32) YTHDC1MMP13TPMTALDH1A1
SCHEMBL17683749 0.85 YTHDC1 (0.34) YTHDC1KMT2ATPMT
SCHEMBL17545039 0.83 EHMT2 (0.36) MMP13MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL19522722 0.76 KDM4C (0.42) MEN1KMT2A
SCHEMBL17544922 0.75 EHMT2 (0.40) ALDH1A1SMN1; SMN2
SCHEMBL17670332 0.74 ALDH1A1 (0.34) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL17683817 0.74 ALDH1A1 (0.34) MEN1MAPTKMT2AALDH1A1SMN1; SMN2
SCHEMBL17670496 0.73 ALDH1A1 (0.40) MEN1KMT2AL3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL17670347 0.72 NPC1 (0.39) MEN1MAPTKMT2AL3MBTL1ALDH1A1

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
US-9802941-B2 Compounds and methods for inhibiting histone demethylases GILEAD SCIENCES, INC. (US) 2017-10-31 — — US disclosed
US-9802941-B2 Compounds and methods for inhibiting histone demethylases GILEAD SCIENCES, INC. (US) 2017-10-31 — — US disclosed
US-20160102096-A1 COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES EPITHERAPEUTICS APS 2016-04-14 — — 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-20160102096-A1 COMPOUNDS AND METHODS FOR INHIBITING HISTONE DEMETHYLASES PHF8, KDM3A, PHF2 YTHDC1 920/4885MMP13 397/4885MEN1 3634/4885

“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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