SCHEMBL23809153

SCHEMBL23809153

CC(C)c1cc(COCC2COC2)cc2cc(C(=O)O)n(C)c12

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
SRD5A2 P31213 2/20 0.33
SRD5A1 P18405 1/20 0.31
MCL1 Q07820 2/20 0.30
GPR35 Q9HC97 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
FKBP1A P62942 1/20 0.30

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
SCHEMBL23809487 0.84 MCL1 (0.38) HSD17B10KDM4EALDH1A1HPGDSRD5A2
SCHEMBL23809489 0.81 HSD17B10 (0.46) HSD17B10KDM4EALDH1A1HPGDSRD5A2
SCHEMBL23809314 0.79 KDM4E (0.41) KDM4EALDH1A1MAPK1
SCHEMBL23809282 0.79 ALDH1A1 (0.42) HSD17B10KDM4EALDH1A1HPGDSRD5A2
SCHEMBL23809517 0.77 ALDH1A1 (0.38) HSD17B10KDM4EALDH1A1HPGDSRD5A2
SCHEMBL23809431 0.74 MAPT (0.43) HSD17B10KDM4EALDH1A1HPGD
SCHEMBL23809100 0.73 KDM4E (0.39) HSD17B10KDM4EALDH1A1HPGDSRD5A2
SCHEMBL23809525 0.73 HRH3 (0.41) HSD17B10KDM4EALDH1A1HPGDMAPK1
SCHEMBL26037572 0.71 HRH3 (0.39) HSD17B10KDM4EALDH1A1HPGD
SCHEMBL26037543 0.71 MCL1 (0.44) HSD17B10KDM4EALDH1A1HPGDSRD5A2

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 HSD17B10 3627/4885KDM4E 1156/4885ALDH1A1 2556/4885

“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.