SCHEMBL17113154

SCHEMBL17113154

COC(=O)c1cc(N)c2ccn(C)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.48
KDM4E B2RXH2 10/20 0.48
ALDH1A1 P00352 7/20 0.47
HPGD P15428 6/20 0.47
MAPT P10636 6/20 0.47
GAA P10253 4/20 0.47
HSD17B10 Q99714 2/20 0.47
GLA P06280 1/20 0.47
CASP1 P29466 1/20 0.47
CASP7 P55210 1/20 0.47
ATM Q13315 1/20 0.47
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 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
SCHEMBL13187075 0.83 KDM4E (0.49) KDM4EALDH1A1MAPTGAACA12
SCHEMBL13500645 0.82 KDM4E (0.45) USP2KDM4EALDH1A1HPGDMAPT
SCHEMBL23937676 0.82 HPGD (0.38) KDM4EHPGDSMN1; SMN2CA2TUBB4A
SCHEMBL29855962 0.82 KDM4E (0.48) USP2KDM4EALDH1A1GAAHSD17B10
SCHEMBL348258 0.82 KDM4E (0.48) USP2KDM4EALDH1A1GAAHSD17B10
SCHEMBL13307570 0.82 KDM4E (0.48) USP2KDM4EALDH1A1MAPTGAA
SCHEMBL26119676 0.81 KDM4E (0.44) USP2KDM4EALDH1A1HPGDMAPT
SCHEMBL5221750 0.81 KDM4E (0.44) USP2KDM4EALDH1A1HPGDMAPT
Hydrochloric Acid SCHEMBL5222518 0.80 KDM4E (0.43) USP2KDM4EALDH1A1HPGDMAPT
SCHEMBL16759762 0.80 KDM4E (0.43) USP2KDM4EALDH1A1HPGDMAPT

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-12195472-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2025-01-14 US disclosed
US-20230039309-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-02-09 US disclosed
US-11208415-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2021-12-28 US disclosed
CN-106456602-B Substituted indole MCL-1 inhibitors 范德比尔特大学 2020-11-24 CN disclosed
EP-3122353-B1 SUBSTITUTED INDOLE MCL-1 INHIBITORS UNIV VANDERBILT (US) 2020-10-28 EP disclosed
US-20200140447-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2020-05-07 US disclosed
US-20170174689-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2017-06-22 US disclosed
EP-3122353-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2017-02-01 EP disclosed
WO-2015148854-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY (US) 2015-10-01 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 (5 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-20200140447-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 USP2 451/4885KDM4E 814/4885ALDH1A1 1900/4885
US-20230039309-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 USP2 451/4885KDM4E 814/4885ALDH1A1 1900/4885
US-12195472-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL3 USP2 451/4885KDM4E 814/4885ALDH1A1 1900/4885
US-20170174689-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL3 USP2 451/4885KDM4E 814/4885ALDH1A1 1900/4885
US-11208415-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL3 USP2 451/4885KDM4E 814/4885ALDH1A1 1900/4885

“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.