SCHEMBL23800342

SCHEMBL23800342

COC(=O)c1cc(Br)cc2c1ncn2C

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 14/20 0.39
MAP2K2 P36507 2/20 0.38
MAP2K1 Q02750 2/20 0.38
ABCB11 O95342 1/20 0.38
NQO2 P16083 1/20 0.38
NR4A2 P43354 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SMC2 O95347 1/20 0.37
EGFR P00533 1/20 0.37
CSNK2A2 P19784 1/20 0.37
SMC1A Q14683 1/20 0.37
AAK1 Q2M2I8 1/20 0.37
Q6ZSR9 Q6ZSR9 1/20 0.37
BMP2K Q9NSY1 1/20 0.37
EGLN1 Q9GZT9 1/20 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
SCHEMBL30521347 1.00 OPRK1 (0.39) OPRK1MAP2K2MAP2K1ABCB11NQO2
SCHEMBL31286477 0.83 AKR1C3 (0.40) MAP2K2MAP2K1ABCB11NQO2KDM4E
SCHEMBL30520683 0.81 ALDH1A1 (0.41) NR4A2KDM4EEGLN1
SCHEMBL30521062 0.79 EGLN1 (0.37) NR4A2KDM4EEGLN1
SCHEMBL30242139 0.78 ATR (0.39) OPRK1
SCHEMBL23925396 0.78 ATR (0.39) OPRK1
SCHEMBL17910027 0.77 KMT2A (0.37) OPRK1NR4A2KDM4E
SCHEMBL30733305 0.77 MAP2K2 (0.42) MAP2K2MAP2K1ABCB11NQO2NR4A2
SCHEMBL30073351 0.77 ALDH1A1 (0.40) KDM4E
SCHEMBL30618046 0.77 KMT2A (0.37) OPRK1NR4A2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12144816-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2024-11-19 US disclosed
WO-2024231852-A1 SUBSTITUTED BIPHENYL COMPOUNDS AS CBL-B INHIBITORS GLENMARK PHARMACEUTICALS LTD (IN) 2024-11-14 WO disclosed
EP-4292662-A2 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2023-12-20 EP disclosed
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 US disclosed
EP-3423435-B1 SUBSTITUTED INDOLE MCL-1 INHIBITORS UNIV VANDERBILT (US) 2023-08-23 EP disclosed
US-11596639-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2023-03-07 US disclosed
CN-109153643-B Substituted indole MCL-1 inhibitors 范德比尔特大学 2022-06-21 CN disclosed
US-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2021-09-16 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 (4 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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 OPRK1 2351/4885MAP2K2 1021/4885MAP2K1 1491/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 OPRK1 2351/4885MAP2K2 1021/4885MAP2K1 1491/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 OPRK1 2351/4885MAP2K2 1021/4885MAP2K1 1491/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 OPRK1 2351/4885MAP2K2 1021/4885MAP2K1 1491/4885

“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.