SCHEMBL23244263

SCHEMBL23244263

O=C(c1n[nH]c2ccccc12)N1CCN(c2ccc(O)cc2)CC1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.77
MAPT P10636 4/20 0.77
LMNA P02545 5/20 0.62
TSHR P16473 3/20 0.62
HPGD P15428 1/20 0.62
FLT3 P36888 4/20 0.60
GAA P10253 3/20 0.53
HTT P42858 3/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
USP2 O75604 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
RBP4 P02753 1/20 0.51
DRD2 P14416 3/20 0.50
HTR1A P08908 2/20 0.50
HTR2A P28223 2/20 0.50
MAPK1 P28482 1/20 0.50
DRD3 P35462 1/20 0.50
KDM4E B2RXH2 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL29576417 1.00 ALDH1A1 (0.77) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL15253964 0.89 TSHR (0.77) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL21855639 0.81 FLT3 (0.65) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL30589612 0.81 ALDH1A1 (0.64) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL15253698 0.81 ALDH1A1 (0.64) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL20181949 0.80 FLT3 (0.69) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL13779981 0.80 FLT3 (0.69) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL29806029 0.80 FLT3 (0.69) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL6114106 0.80 FLT3 (0.67) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL12944184 0.79 ALDH1A1 (0.64) ALDH1A1MAPTLMNATSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220127266-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2022-04-28 US claimed
WO-2021074898-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) 2021-04-22 WO claimed
US-20210115038-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2021-04-22 US claimed
US-20220127266-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2022-04-28 US disclosed
US-20220127266-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2022-04-28 US disclosed
US-11225480-B2 Malic enzyme inhibitors SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2022-01-18 US disclosed
US-11225480-B2 Malic enzyme inhibitors SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2022-01-18 US disclosed
WO-2021074898-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) 2021-04-22 WO disclosed
WO-2021074898-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) 2021-04-22 WO disclosed
US-20210115038-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2021-04-22 US disclosed
US-20210115038-A1 MALIC ENZYME INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2021-04-22 US 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-20210115038-A1 MALIC ENZYME INHIBITORS ME1, ME2, ME3 ALDH1A1 144/4885MAPT 2817/4885LMNA 4129/4885
US-11225480-B2 Malic enzyme inhibitors ME1, RNASE1, ME2 ALDH1A1 89/4885MAPT 3825/4885LMNA 3853/4885
US-20220127266-A1 MALIC ENZYME INHIBITORS ME1, ME2, ME3 ALDH1A1 144/4885MAPT 2817/4885LMNA 4129/4885

“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.