SCHEMBL29863107

SCHEMBL29863107

CC(C)(C)OC(=O)Nc1ncnc2c1ncn2Cc1c(CO)cc(Cl)cc1N1CC[C@](NC(=O)OC(C)(C)C)(C(=O)NC2CC2)C1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 1/20 0.34
▸ NSD2 O96028 7/20 0.34
▸ SLC29A1 Q99808 1/20 0.33
▸ CNR2 P34972 3/20 0.32
▸ CNR1 P21554 2/20 0.32
▸ USP7 Q93009 1/20 0.32
▸ FGFR1 P11362 1/20 0.31
▸ FGFR4 P22455 1/20 0.31
▸ SUV39H2 Q9H5I1 2/20 0.31
▸ DRD2 P14416 2/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ DRD3 P35462 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
SCHEMBL23121008 0.97 DDR1 (0.33) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL23121011 0.97 DDR1 (0.33) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL29862847 0.95 DDR1 (0.34) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL23136410 0.95 DDR1 (0.34) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL23121105 0.92 DDR1 (0.34) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL23121102 0.92 DDR1 (0.34) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL23121415 0.92 DDR1 (0.34) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL23121416 0.92 DDR1 (0.34) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL29862692 0.92 NSD2 (0.33) DDR1NSD2SLC29A1CNR2CNR1
SCHEMBL23120978 0.91 CNR2 (0.33) DDR1NSD2SLC29A1CNR2CNR1

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
EP-4013756-B1 MLL1 INHIBITORS AND ANTI-CANCER AGENTS NOVARTIS AG (CH) 2024-05-08 — — EP disclosed
US-20220380371-A1 MLL1 INHIBITORS AND ANTI-CANCER AGENTS CHINA NOVARTIS INSTITUTES FOR BIOMEDICAL RESEARCH CO., LTD. (CN) 2022-12-01 — — US disclosed
EP-4013756-A1 MLL1 INHIBITORS AND ANTI-CANCER AGENTS Novartis AG (CH) 2022-06-22 — — EP 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-20220380371-A1 MLL1 INHIBITORS AND ANTI-CANCER AGENTS MLLT1, BMI1, DOT1L DDR1 2446/4885NSD2 102/4885SLC29A1 2587/4885

“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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