SCHEMBL17677964

SCHEMBL17677964

Cn1nc(NCCN2CCCC2)c2ccc(Br)cc21

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KAT2B Q92831 4/20 0.55
▸ KMT5A Q9NQR1 1/20 0.41
▸ ACHE P22303 3/20 0.41
▸ TOP2A P11388 1/20 0.40
▸ SIGMAR1 Q99720 3/20 0.39
▸ POLB P06746 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL17677956 0.93 KAT2B (0.47) KAT2BKMT5AALDH1A1
SCHEMBL17677957 0.91 KAT2B (0.46) KAT2BKMT5A
SCHEMBL17677961 0.89 CYP3A4 (0.46) KAT2BACHETOP2APOLBKDM4E
SCHEMBL17677958 0.82 ALDH1A1 (0.52) POLBKDM4EALDH1A1LMNAHPGD
SCHEMBL17677954 0.79 KAT2B (0.53) KAT2B
SCHEMBL17677953 0.78 KAT2B (0.48) KAT2BKMT5AACHETOP2ASIGMAR1
SCHEMBL22119625 0.77 APEX1 (0.46) KDM4EALDH1A1MEN1KMT2A
SCHEMBL29976679 0.77 APEX1 (0.46) KDM4EALDH1A1MEN1KMT2A
SCHEMBL31195516 0.76 PDGFRA (0.41) KAT2B
SCHEMBL21026023 0.76 KMT2A (0.44) SIGMAR1KDM4EALDH1A1HSD17B10MEN1

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-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2019-05-23 — — US 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

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 KAT2B 2098/4885KMT5A 3496/4885ACHE 4517/4885

“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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