SCHEMBL19032233

SCHEMBL19032233

CC1(C)CN=C(N2CC3(C2)CN(c2ncnc4ccc(OC(F)(F)F)cc24)C3)S1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 15/20 0.46
▸ KMT2A Q03164 5/20 0.44
▸ PDE3B Q13370 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ MAPK7 Q13164 2/20 0.39
▸ KIT P10721 1/20 0.36

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
SCHEMBL19049697 0.90 MEN1 (0.57) MEN1KMT2APDE3BPDE3AMAPK7
SCHEMBL19032166 0.79 PDE3B (0.39) MEN1KMT2APDE3BPDE3AMAPK7
SCHEMBL19032180 0.78 PDE3B (0.42) PDE3BPDE3AMAPK7KIT
SCHEMBL25275560 0.77 PIM1 (0.48) MEN1KMT2APDE3BPDE3AMAPK7
SCHEMBL19032267 0.75 MAPK7 (0.47) PDE3BPDE3AMAPK7KIT
SCHEMBL25423050 0.73 MAPK7 (0.48) PDE3BPDE3AMAPK7KIT
SCHEMBL19032363 0.72 MTNR1B (0.41) PDE3BPDE3AMAPK7KIT
SCHEMBL30405719 0.71 MAPK7 (0.47) MAPK7KIT
SCHEMBL25232266 0.71 MAPK7 (0.47) MAPK7KIT
SCHEMBL30543218 0.70 AKT2 (0.46) PDE3BPDE3AMAPK7KIT

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-20190010167-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. 2019-01-10 — — US claimed
US-20230095934-A1 TREATMENT OF HEMATOLOGICAL MALIGNANCIES WITH INHIBITORS OF MENIN KURA ONCOLOGY, INC. 2023-03-30 — — US disclosed
US-20230026872-A1 METHODS FOR TREATING HEMATOLOGICAL MALIGNANCIES AND EWING'S SARCOMA KURA ONCOLOGY, INC. 2023-01-26 — — US disclosed
US-20190010167-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. 2019-01-10 — — US disclosed
EP-3394064-A1 INHIBITORS OF THE MENIN-MLL INTERACTION Vitae Pharmaceuticals, Inc. (US) 2018-10-31 — — EP disclosed
WO-2017112768-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. (US) 2017-06-29 — — WO disclosed
WO-2017112768-A1 INHIBITORS OF THE MENIN-MLL INTERACTION VITAE PHARMACEUTICALS, INC. (US) 2017-06-29 — — 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 (3 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-20230026872-A1 METHODS FOR TREATING HEMATOLOGICAL MALIGNANCIES AND EWING'S SARCOMA MEN1, DIAPH1, EWSR1 MEN1 1/4885KMT2A 218/4885PDE3B 2369/4885
US-20230095934-A1 TREATMENT OF HEMATOLOGICAL MALIGNANCIES WITH INHIBITORS OF MENIN MEN1, MCL1, XPOT MEN1 1/4885KMT2A 176/4885PDE3B 1677/4885
US-20190010167-A1 INHIBITORS OF THE MENIN-MLL INTERACTION MLLT1, MEN1, MLLT3 MEN1 2/4885KMT2A 12/4885PDE3B 4739/4885

“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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