SCHEMBL23809402

SCHEMBL23809402

Cc1nc(-c2ccc3c(c2)c(C(C)C)cn3C)no1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
GSK3B P49841 1/20 0.39
SCARB1 Q8WTV0 1/20 0.39
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
PLK1 P53350 1/20 0.37
MMP12 P39900 1/20 0.37
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
ALOX5AP P20292 1/20 0.36
RARA P10276 1/20 0.35
RARB P10826 1/20 0.35
RARG P13631 1/20 0.35
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34

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
SCHEMBL26581410 0.84 L3MBTL1 (0.51) L3MBTL1GSK3BSCARB1CA12CA1
SCHEMBL20605166 0.82 L3MBTL1 (0.49) L3MBTL1GSK3BSCARB1CA12CA1
SCHEMBL23809498 0.80 ACHE (0.42) SCARB1MAPT
SCHEMBL23809238 0.78 HSD17B2 (0.34) RAB9A
SCHEMBL23809246 0.77 MEN1 (0.43) LMNAMAPT
SCHEMBL23809218 0.74 DRD2 (0.42) LMNAMAPT
SCHEMBL8226427 0.74 L3MBTL1 (0.56) L3MBTL1GSK3BCA12CA1CA2
SCHEMBL23809227 0.73 TP53 (0.49) LMNARAB9AMAPT
SCHEMBL23809461 0.73 NR4A2 (0.34) LMNAMAPT
SCHEMBL20605211 0.72 L3MBTL1 (0.54) L3MBTL1CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 L3MBTL1 135/4885GSK3B 196/4885SCARB1 3521/4885

“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.