SCHEMBL19972686

SCHEMBL19972686

CC(C)N(C(=O)c1cc(F)ccc1-n1cc(C2CN(CCC3CCC(N)CC3)C2)c2ccncc21)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 2/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NFATC1 O95644 1/20 0.32
GSK3B P49841 1/20 0.32
DYRK1A Q13627 1/20 0.32
HRH2 P25021 2/20 0.32
HTR2A P28223 3/20 0.32
DRD3 P35462 3/20 0.32
PIM3 Q86V86 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
RORC P51449 2/20 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
SCHEMBL19972688 1.00 KDM4C (0.36) KDM4CPTGDR2MEN1KMT2ANFATC1
SCHEMBL23515871 1.00 KDM4C (0.36) KDM4CPTGDR2MEN1KMT2ANFATC1
SCHEMBL19980685 0.92 KDM4C (0.36) KDM4CPTGDR2MEN1KMT2ANFATC1
SCHEMBL31001728 0.91 KDM4C (0.35) KDM4CPTGDR2MEN1KMT2ANFATC1
SCHEMBL19972484 0.90 KDM4C (0.38) KDM4CMEN1KMT2AHTR2ADRD3
SCHEMBL19972486 0.90 KDM4C (0.38) KDM4CMEN1KMT2AHTR2ADRD3
SCHEMBL19972630 0.89 HRH2 (0.37) KDM4CHRH2HTR2ADRD3
SCHEMBL30524044 0.89 MEN1 (0.45) KDM4CMEN1KMT2AHTR2ADRD3
SCHEMBL19972628 0.89 HRH2 (0.37) KDM4CHRH2HTR2ADRD3
SCHEMBL19972521 0.89 MEN1 (0.45) KDM4CMEN1KMT2AHTR2ADRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118359610-A MENIN-MLL interaction inhibitors 生命医药有限责任公司 2024-07-19 CN disclosed
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 KDM4C 397/4885PTGDR2 4545/4885MEN1 2/4885
US-10899758-B2 Inhibitors of the menin-MLL interaction MLLT1, MEN1, MLLT3 KDM4C 397/4885PTGDR2 4545/4885MEN1 2/4885
US-20190202830-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 KDM4C 397/4885PTGDR2 4545/4885MEN1 2/4885
US-20240124447-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 KDM4C 397/4885PTGDR2 4545/4885MEN1 2/4885
US-20210179611-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 KDM4C 397/4885PTGDR2 4545/4885MEN1 2/4885

“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.