SCHEMBL24524686

SCHEMBL24524686

CCOC(=O)c1c(Br)c(C)nn1CCOCCOC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HPGD P15428 3/20 0.37
HTT P42858 3/20 0.35
MAPK1 P28482 4/20 0.35
TP53 P04637 2/20 0.35
KDM4E B2RXH2 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KMT2A Q03164 2/20 0.35
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
ABCB11 O95342 1/20 0.33
CYP3A4 P08684 1/20 0.33
ADRA2B P18089 1/20 0.33
OPRD1 P41143 1/20 0.33
SCN5A Q14524 1/20 0.33

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
SCHEMBL19622608 0.77 KMT2A (0.37) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL1431561 0.74 ALDH1A1 (0.46) MAPTALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL24524621 0.74 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL19635162 0.73 CYP3A4 (0.47) MAPTALDH1A1SMN1; SMN2HPGDMAPK1
SCHEMBL24524644 0.72 MEN1 (0.38) MAPTALDH1A1HPGDHTTMAPK1
SCHEMBL841946 0.71 KDM4E (0.49) MAPTALDH1A1SMN1; SMN2KDM4EHSD17B10
SCHEMBL1407215 0.71 ALDH1A1 (0.46) MAPTALDH1A1SMN1; SMN2HTTKDM4E
SCHEMBL19635863 0.70 MAPT (0.40) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL22125747 0.70 MAPK1 (0.62) MAPTALDH1A1SMN1; SMN2HPGDHTT
SCHEMBL29049939 0.69 LMNA (0.44) MAPTALDH1A1SMN1; SMN2HPGDMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2023-04-27 US disclosed
US-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2023-04-27 US disclosed
WO-2022129333-A1 BRANCHED MACROCYCLIC 4-(PYRAZOL-5-YL)-INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 JANSSEN PHARMACEUTICA NV (BE) 2022-06-23 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 (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-20230130109-A1 MACROCYCLIC INDOLE DERIVATIVES AS INHIBITORS OF MCL-1 MCL1, BCL2L1, BAK1 MAPT 3113/4885ALDH1A1 1067/4885SMN1; SMN2 2915/4885

“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.