SCHEMBL23809113

SCHEMBL23809113

COCCn1c(C(=O)O)cc2cc(C(C)C)cc(C(C)C)c21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.41
FABP4 P15090 1/20 0.41
CASR P41180 13/20 0.37
MCL1 Q07820 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CCNC P24863 1/20 0.35
CDK8 P49336 1/20 0.35
HASPIN Q8TF76 1/20 0.35
PHGDH O43175 1/20 0.33
MAPT P10636 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
SCHEMBL23809284 0.89 ALDH1A1 (0.38) CASRMCL1ALDH1A1KDM4EHPGD
SCHEMBL23809215 0.86 ALDH1A1 (0.41) CASRMCL1ALDH1A1KDM4EHPGD
SCHEMBL23809529 0.84 NTRK1 (0.38) MCL1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23809128 0.82 CCR2 (0.42) CASRMCL1ALDH1A1CCNCCDK8
SCHEMBL23809272 0.82 MCL1 (0.35) CASRMCL1ALDH1A1KDM4EHPGD
SCHEMBL26036900 0.81 MCL1 (0.39) MCL1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23809536 0.78 ALDH1A1 (0.33) MCL1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23809535 0.77 KDM4E (0.36) MCL1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL23809274 0.76 CCR2 (0.40) CASRMCL1ALDH1A1KDM4E
SCHEMBL26581456 0.75 ALDH1A1 (0.40) MCL1ALDH1A1KDM4EHPGDHSD17B10

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 FABP3 2246/4885FABP4 3317/4885CASR 4797/4885

“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.