SCHEMBL19972620

SCHEMBL19972620

CC(C)N(C)C(=O)c1cc(F)ccc1-n1cc(C2CC3CN(C[C@H]4C[C@H](NC(=O)O)C4)CC3C2)c2ccncc21

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.31
HTR3A P46098 2/20 0.31
CCNT1 O60563 1/20 0.30
CDK9 P50750 1/20 0.30
KDM4C Q9H3R0 1/20 0.30
RBP4 P02753 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
SCHEMBL19972518 0.91 MEN1 (0.37) PTGDR2CCNT1CDK9
SCHEMBL30265706 0.91 MEN1 (0.37) PTGDR2CCNT1CDK9
SCHEMBL30265760 0.91 NPY5R (0.35)
SCHEMBL19980695 0.91 NPY5R (0.35)
SCHEMBL19972588 0.90 PIM2 (0.32) PTGDR2CCNT1CDK9
SCHEMBL19980686 0.89 OPRM1 (0.39) PTGDR2CCNT1CDK9KDM4C
SCHEMBL30524053 0.87 MEN1 (0.42) PTGDR2KDM4C
SCHEMBL19972591 0.87 MEN1 (0.42) PTGDR2KDM4C
SCHEMBL19972715 0.87 CCNT1 (0.32) CCNT1CDK9
SCHEMBL19972578 0.87 OPRM1 (0.38) KDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124447-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, LLC (US) 2024-04-18 US disclosed
US-11739085-B2 Inhibitors of the menin-MLL interaction VITAE PHARMACEUTICALS, LLC (US) 2023-08-29 US disclosed
EP-4230627-A2 INHIBITORS OF THE MENIN-MLL INTERACTION Vitae Pharmaceuticals, LLC (US) 2023-08-23 EP disclosed
EP-3512850-B1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS LLC (US) 2023-04-12 EP disclosed
US-20210179611-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, LLC (US) 2021-06-17 US disclosed
US-10899758-B2 Inhibitors of the menin-MLL interaction VITAE PHARMACEUTICALS, LLC (US) 2021-01-26 US disclosed
EP-3512850-A1 INHIBITORS OF THE MENIN-MLL INTERACTION Vitae Pharmaceuticals, Inc. (US) 2019-07-24 EP disclosed
US-20190202830-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. 2019-07-04 US disclosed
WO-2018053267-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. (US) 2018-03-22 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-11739085-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 PTGDR2 4545/4885HTR3A 4661/4885CCNT1 1833/4885
US-10899758-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 PTGDR2 4545/4885HTR3A 4661/4885CCNT1 1833/4885
US-20190202830-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 PTGDR2 4545/4885HTR3A 4661/4885CCNT1 1833/4885
US-20240124447-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 PTGDR2 4545/4885HTR3A 4661/4885CCNT1 1833/4885
US-20210179611-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 PTGDR2 4545/4885HTR3A 4661/4885CCNT1 1833/4885

“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.