SCHEMBL23809482

SCHEMBL23809482

COCCn1cc(C(C)C)c2cc(C(=O)O)ccc21

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 1/20 0.49
HCAR3 P49019 2/20 0.48
ALDH1A1 P00352 2/20 0.45
CNR1 P21554 3/20 0.45
ACE2 Q9BYF1 2/20 0.43
CNR2 P34972 3/20 0.42
KDM4E B2RXH2 2/20 0.41
PTGER4 P35408 1/20 0.41
HPGD P15428 1/20 0.40
HRH2 P25021 1/20 0.39

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
SCHEMBL23809463 0.86 SLC22A12 (0.52) SLC22A12HCAR3ALDH1A1ACE2KDM4E
SCHEMBL23809350 0.82 SLC22A12 (0.49) SLC22A12ALDH1A1ACE2CNR2KDM4E
SCHEMBL23809277 0.81 SLC22A12 (0.47) SLC22A12ALDH1A1CNR1ACE2CNR2
SCHEMBL23809337 0.80 SLC22A12 (0.47) SLC22A12ALDH1A1CNR1ACE2CNR2
SCHEMBL23809523 0.80 SLC22A12 (0.51) SLC22A12HCAR3ALDH1A1ACE2KDM4E
SCHEMBL1554607 0.78 ACE2 (0.51) SLC22A12HCAR3ALDH1A1ACE2KDM4E
SCHEMBL23809366 0.78 SLC22A12 (0.45) SLC22A12HCAR3ACE2KDM4EHPGD
SCHEMBL23809421 0.76 DYRK1A (0.40) CNR1CNR2
SCHEMBL23809481 0.76 SLC22A12 (0.53) SLC22A12ALDH1A1CNR1ACE2CNR2
SCHEMBL13578013 0.75 SLC22A12 (0.61) SLC22A12HCAR3ALDH1A1CNR1PTGER4

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 SLC22A12 3136/4885HCAR3 4325/4885ALDH1A1 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.