SCHEMBL26580967

SCHEMBL26580967

Cc1nc(COCc2ccccc2)nc(C)c1C

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.45
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
STAT3 P40763 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.39
CA1 P00915 1/20 0.39
APP P05067 1/20 0.38
IDO1 P14902 1/20 0.38
DHODH Q02127 1/20 0.37
CYP1A2 P05177 1/20 0.37
AGXT P21549 1/20 0.36
ATP4A P20648 1/20 0.36
ATP4B P51164 1/20 0.36
VCP P55072 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
SCHEMBL26037955 0.86 TSHR (0.52) TSHRL3MBTL1STAT3HTTSMN1; SMN2
SCHEMBL20604774 0.86 TSHR (0.52) TSHRL3MBTL1MAPTMAPK1TDP1
SCHEMBL23809146 0.83 TSHR (0.48) TSHRL3MBTL1MAPTMAPK1TDP1
SCHEMBL20604722 0.82 TSHR (0.47) TSHRL3MBTL1MAPTMAPK1TDP1
SCHEMBL29091864 0.77 TSHR (0.94) TSHRALDH1A1CA1IDO1CYP1A2
SCHEMBL20605133 0.76 DGAT1 (0.41) TSHRL3MBTL1STAT3HTTSMN1; SMN2
SCHEMBL26328836 0.76 TSHR (0.58) TSHRL3MBTL1MAPTMAPK1TDP1
SCHEMBL27380 0.74 TSHR (1.00) TSHRALDH1A1CA1IDO1CYP1A2
SCHEMBL5311581 0.74 TSHR (1.00) TSHRALDH1A1CA1IDO1CYP1A2
Benzene SCHEMBL27997624 0.74 TSHR (1.00) TSHRALDH1A1CA1IDO1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 US disclosed
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 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-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 TSHR 4309/4885L3MBTL1 135/4885MAPT 2996/4885

“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.