SCHEMBL13826606

SCHEMBL13826606

CCOc1ccc(-c2n[nH]c3ncnc(N)c23)cc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 8/20 0.47
▸ ABL1 P00519 8/20 0.47
▸ EGFR P00533 8/20 0.47
▸ HCK P08631 8/20 0.47
▸ SRC P12931 8/20 0.47
▸ KDR P35968 8/20 0.47
▸ PIK3CA P42336 8/20 0.47
▸ PIK3CB P42338 8/20 0.47
▸ MTOR P42345 8/20 0.47
▸ PIK3CG P48736 8/20 0.47
▸ EPHB4 P54760 8/20 0.47
▸ PRKDC P78527 8/20 0.47
▸ PI4KB Q9UBF8 8/20 0.47
▸ CTSS P25774 6/20 0.43
▸ CTSK P43235 4/20 0.43
▸ RXRA P19793 1/20 0.43
▸ RXRB P28702 1/20 0.43
▸ RXRG P48443 1/20 0.43
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 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
SCHEMBL217790 0.85 ABL1 (0.49) PIK3CDABL1EGFRHCKSRC
SCHEMBL16665685 0.83 PIK3CD (0.67) PIK3CDABL1EGFRHCKSRC
SCHEMBL19414369 0.78 PIK3CD (0.64) PIK3CDABL1EGFRHCKSRC
SCHEMBL19414293 0.77 ALDH1A1 (0.50) PIK3CDABL1EGFRHCKSRC
SCHEMBL20093454 0.77 SRC (0.61) PIK3CDABL1EGFRHCKSRC
SCHEMBL149180 0.76 PIK3CD (0.55) PIK3CDABL1EGFRHCKSRC
SCHEMBL19414398 0.75 MAP4K4 (0.54) PIK3CDABL1EGFRHCKSRC
SCHEMBL11306 0.75 SRC (0.47) PIK3CDABL1EGFRHCKSRC
SCHEMBL21575209 0.75 BTK (0.53) ABL1KDRCTSSCTSKRXRA
SCHEMBL19414295 0.73 SRC (0.47) PIK3CDABL1EGFRHCKSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210401840-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2021-12-30 — — US disclosed
US-10322130-B2 Substituted chromenones as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2019-06-18 — — US disclosed
US-20190105324-A9 SUBSTITUTED CHROMENONES AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS AG (CH) 2019-04-11 — — US disclosed
US-10220035-B2 Compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2019-03-05 — — US disclosed
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2018-04-26 — — US disclosed
WO-2012151525-A9 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-12-13 — — WO disclosed
WO-2012151525-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2012-11-08 — — 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 (5 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-20210401840-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PIK3CD 47/4885ABL1 334/4885EGFR 1359/4885
US-20190105324-A9 SUBSTITUTED CHROMENONES AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKAR2B PIK3CD 89/4885ABL1 464/4885EGFR 1502/4885
US-10220035-B2 Compounds as modulators of protein kinases PRKCA, PRKCH, PRKCE PIK3CD 30/4885ABL1 297/4885EGFR 1203/4885
US-20180110783-A1 NOVEL COMPOUNDS AS MODULATORS OF PROTEIN KINASES PRKCA, PRKCH, PRKCB PIK3CD 47/4885ABL1 334/4885EGFR 1359/4885
US-10322130-B2 Substituted chromenones as modulators of protein kinases MAP3K1, CSNK1A1, MAP3K2 PIK3CD 148/4885ABL1 376/4885EGFR 807/4885

“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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