SCHEMBL18319965

SCHEMBL18319965

NC(=O)Oc1cc(O)cc(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPT P10636 1/20 0.41
BACE1 P56817 2/20 0.40
CA12 O43570 4/20 0.39
CA1 P00915 4/20 0.39
CA2 P00918 4/20 0.39
CA7 P43166 4/20 0.39
CA9 Q16790 4/20 0.39
CA14 Q9ULX7 4/20 0.39
KIF11 P52732 1/20 0.38
CYP3A4 P08684 2/20 0.38
NQO2 P16083 1/20 0.37
CA5A P35218 1/20 0.37
LCK P06239 1/20 0.36
FASN P49327 1/20 0.34
HSP90AB1 P08238 1/20 0.34
PARP10 Q53GL7 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34

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
SCHEMBL28604363 0.85 KMT2A (0.50) MEN1KMT2AMAPTBACE1CYP3A4
SCHEMBL3641396 0.78 MEN1 (0.76) MEN1KMT2ACA12CA1CA2
SCHEMBL16005812 0.78 PTGS2 (0.60) MEN1KMT2AMAPTCA12CA1
SCHEMBL1128210 0.77 CA12 (0.46) MEN1KMT2AMAPTBACE1CA12
SCHEMBL10884885 0.76 MEN1 (0.50) MEN1KMT2AKIF11LCKLMNA
SCHEMBL28940984 0.76 APLNR (0.46) MEN1KMT2AHSD17B10
SCHEMBL320560 0.75 CYP3A4 (0.63) MEN1KMT2AMAPTBACE1CA12
SCHEMBL11075044 0.75 KMT2A (0.60) MEN1KMT2AMAPTKIF11CYP3A4
SCHEMBL4642280 0.75 MEN1 (0.41) MEN1KMT2AMAPTBACE1CA12
SCHEMBL11703365 0.75 MEN1 (0.41) MEN1KMT2AMAPTBACE1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3310775-B1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES Bayer Pharma AG (DE) 2020-04-01 EP disclosed
US-10227299-B2 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-03-12 US disclosed
US-20180155285-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-06-07 US disclosed
EP-3310775-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-04-25 EP disclosed
WO-2016202755-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-22 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 (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-10227299-B2 3-amino-1,5,6,7-tetrahydro-4H-indol-4-ones MYC, HCCS, MCL1 MEN1 2186/4885KMT2A 1933/4885MAPT 2121/4885
US-20180155285-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES HCCS, MCL1, MKI67 MEN1 1782/4885KMT2A 2091/4885MAPT 2024/4885

“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.