SCHEMBL19615367

SCHEMBL19615367

CN(C)S(=O)(=O)N1CCN(c2ccc(OCc3nn(C)c(CO)c3Br)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SORD Q00796 3/20 0.42
MCL1 Q07820 2/20 0.42
MAPT P10636 4/20 0.41
ALDH1A1 P00352 4/20 0.41
BCL2 P10415 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 3/20 0.37
USP2 O75604 2/20 0.37
MAPK1 P28482 2/20 0.37
ALOX15 P16050 1/20 0.37
HTT P42858 1/20 0.37
RORC P51449 4/20 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
SCHEMBL21802224 0.92 MCL1 (0.45) MEN1KMT2ASORDMCL1MAPT
SCHEMBL19635340 0.89 MEN1 (0.45) MEN1KMT2ASORDMCL1MAPT
SCHEMBL19615270 0.89 MEN1 (0.45) MEN1KMT2AMCL1MAPTALDH1A1
SCHEMBL19615199 0.83 MCL1 (0.41) MEN1KMT2AMCL1MAPTALDH1A1
SCHEMBL21802247 0.82 MAPT (0.44) MAPTALDH1A1SMN1; SMN2L3MBTL1LMNA
SCHEMBL19635460 0.81 MRGPRX4 (0.42) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
SCHEMBL19635391 0.81 MAPT (0.34) MEN1KMT2AMAPTALDH1A1SMN1; SMN2
Acetic Acid SCHEMBL28656086 0.80 MCL1 (0.46) MEN1KMT2ASORDMCL1MAPT
SCHEMBL21802226 0.79 MCL1 (0.44) MEN1KMT2AMCL1MAPTALDH1A1
SCHEMBL28656085 0.79 MCL1 (0.42) MEN1KMT2ASORDMCL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11492358-B1 Macrocyclic indole derivatives THE BROAD INSTITUTE, INC. (US) 2022-11-08 US disclosed
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
EP-3458459-B1 MACROCYCLIC INDOLE DERIVATIVES BAYER AG (DE) 2022-04-27 EP disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-10981932-B2 Macrocyclic indole derivatives BAYER AKTIENGESELLSCHAFT (DE) 2021-04-20 US disclosed
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-03-19 US disclosed
EP-3458459-A1 MACROCYCLIC INDOLE DERIVATIVES Bayer Aktiengesellschaft (DE) 2019-03-27 EP disclosed
WO-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 WO disclosed
WO-2017198341-A1 MACROCYCLIC INDOLE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2017-11-23 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-11492358-B1 Macrocyclic indole derivatives CCND2, CCNT2, IDO1 MEN1 142/4885KMT2A 930/4885SORD 3271/4885
US-10981932-B2 Macrocyclic indole derivatives CCND2, IDO1, CCNT2 MEN1 114/4885KMT2A 772/4885SORD 3544/4885
US-20200087322-A1 MACROCYCLIC INDOLE DERIVATIVES CCND2, CCNA1, CCNT2 MEN1 140/4885KMT2A 897/4885SORD 3414/4885

“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.