SCHEMBL18725652

SCHEMBL18725652

N#Cc1ccc(N2C(=O)OCC2Cc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 11/20 0.47
NR3C2 P08235 1/20 0.45
MTOR P42345 3/20 0.43
PIK3CA P42336 2/20 0.43
KMT2A Q03164 1/20 0.39
GRM5 P41594 1/20 0.38
GRM2 Q14416 1/20 0.37

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
SCHEMBL18725651 1.00 IDH1 (0.47) IDH1NR3C2MTORPIK3CAKMT2A
SCHEMBL18810150 1.00 IDH1 (0.47) IDH1NR3C2MTORPIK3CAKMT2A
SCHEMBL5604547 0.86 IDH1 (0.55) IDH1MTORPIK3CAGRM2
SCHEMBL5604553 0.86 IDH1 (0.55) IDH1MTORPIK3CAGRM2
SCHEMBL14556276 0.81 L3MBTL1 (0.50) IDH1NR3C2MTORPIK3CAKMT2A
SCHEMBL14556299 0.81 L3MBTL1 (0.50) IDH1NR3C2MTORPIK3CAKMT2A
SCHEMBL14556277 0.81 L3MBTL1 (0.50) IDH1NR3C2MTORPIK3CAKMT2A
SCHEMBL4497765 0.79 AR (0.51) IDH1NR3C2KMT2A
SCHEMBL5428237 0.77 TNKS (0.46) IDH1
SCHEMBL5428231 0.77 TNKS (0.46) IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3812040-B1 COMPLEXES JOHNSON MATTHEY PLC (GB) 2023-01-11 EP disclosed
EP-3812040-A1 COMPLEXES Johnson Matthey Public Limited Company (GB) 2021-04-28 EP disclosed
EP-3154689-B1 COMPLEXES JOHNSON MATTHEY PLC (GB) 2021-01-27 EP disclosed
US-9777030-B2 Complexes JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-10-03 US disclosed
US-20170120231-A1 COMPLEXES JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-05-04 US disclosed
EP-3154689-A1 COMPLEXES Johnson Matthey Public Limited Company (GB) 2017-04-19 EP 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 (1 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-20170120231-A1 COMPLEXES AP3M1, CYCS, AP1M1 IDH1 132/4885NR3C2 903/4885MTOR 2390/4885

“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.