SCHEMBL20847153

SCHEMBL20847153

COC(=O)c1ccc2c(c1)[nH]c(=O)n2CCOC1CCCCO1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 15/20 0.51
KDM4E B2RXH2 10/20 0.51
GAA P10253 8/20 0.51
HPGD P15428 7/20 0.51
HSD17B10 Q99714 6/20 0.51
GLA P06280 5/20 0.51
KMT2A Q03164 3/20 0.51
HTT P42858 2/20 0.51
PKM P14618 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 2/20 0.46
MAPK1 P28482 2/20 0.46
RAB9A P51151 1/20 0.46
MAPT P10636 1/20 0.46
THRB P10828 1/20 0.41
LMNA P02545 2/20 0.41
USP2 O75604 1/20 0.41
EPHX2 P34913 1/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL20847149 0.82 HPGD (0.41) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL20847152 0.80 HPGD (0.41) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL7058025 0.79 HPGD (0.62) ALDH1A1HPGDKMT2AHTTSMN1; SMN2
SCHEMBL5320024 0.77 ALDH1A1 (0.58) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL150752 0.77 NPC1 (0.44) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL5318300 0.77 ALDH1A1 (0.52) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL23216255 0.76 KMT2A (0.47) ALDH1A1KDM4EGAAHPGDKMT2A
SCHEMBL378049 0.75 KMT2A (0.43) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL27418998 0.75 ALDH1A1 (0.43) ALDH1A1KDM4EGAAHPGDHSD17B10
SCHEMBL4915808 0.75 KDM4E (0.53) ALDH1A1KDM4EGAAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11649251-B2 Substituted inhibitors of menin-MLL and methods of use KURA ONCOLOGY, INC. (US) 2023-05-16 US disclosed
US-11649251-B2 Substituted inhibitors of menin-MLL and methods of use KURA ONCOLOGY, INC. (US) 2023-05-16 US disclosed
US-20200216471-A1 SUBSTITUTED INHIBITORS OF MENIN-MLL AND METHODS OF USE KURA ONCOLOGY, INC. 2020-07-09 US disclosed
WO-2019060365-A1 SUBSTITUTED INHIBITORS OF MENIN-MLL AND METHODS OF USE KURA ONCOLOGY, INC. (US) 2019-03-28 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 (2 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-11649251-B2 Substituted inhibitors of menin-MLL and methods of use MLLT1, MEN1, MLLT3 ALDH1A1 4538/4885KDM4E 149/4885GAA 4292/4885
US-20200216471-A1 SUBSTITUTED INHIBITORS OF MENIN-MLL AND METHODS OF USE MLLT1, MEN1, MLLT3 ALDH1A1 4538/4885KDM4E 149/4885GAA 4292/4885

“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.