SCHEMBL17673668

SCHEMBL17673668

COC(=O)c1ccc(Nc2cc(-c3ccc4ncn(C)c4c3)nc(N3CCOCC3)n2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 13/20 0.55
▸ LMNA P02545 2/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ALOX15 P16050 1/20 0.54
▸ PIK3CG P48736 3/20 0.51
▸ MTOR P42345 2/20 0.51
▸ PIK3CD O00329 2/20 0.49
▸ PIK3CB P42338 2/20 0.49
▸ PI4KB Q9UBF8 1/20 0.47
▸ MAPK1 P28482 1/20 0.46
▸ TAAR1 Q96RJ0 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ AURKA O14965 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
SCHEMBL17678227 0.93 PIK3CA (0.55) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17673841 0.92 PIK3CA (0.52) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17678069 0.91 PIK3CA (0.49) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17673674 0.90 PIK3CA (0.51) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17673660 0.90 PIK3CA (0.52) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17678209 0.90 PIK3CA (0.53) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17678025 0.90 STK17A (0.56) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17674110 0.89 PIK3CA (0.51) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL21026358 0.89 PIK3CA (0.52) PIK3CALMNAHSD17B10KDM4EALDH1A1
SCHEMBL17678310 0.88 PIK3CA (0.51) PIK3CALMNAHSD17B10KDM4EALDH1A1

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-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2019-05-23 — — US disclosed
US-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2019-05-23 — — US disclosed
EP-3204009-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BioMarin Pharmaceutical Inc. (US) 2017-08-16 — — EP disclosed
WO-2016057834-A9 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2017-04-13 — — WO disclosed
WO-2016057834-A9 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2017-04-13 — — WO disclosed
WO-2016057834-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2016-04-14 — — WO disclosed
WO-2016057834-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2016-04-14 — — 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-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES HPSE, GAA, MAN2B1 PIK3CA 2468/4885LMNA 2070/4885HSD17B10 85/4885

“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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