SCHEMBL24045271

SCHEMBL24045271

Cc1c(CC(=O)O)c(=O)oc2cc(OCc3cccc(Br)c3)ccc12

nearest known ligand 0.80

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC26A3 P40879 6/20 0.74
CTDSP1 Q9GZU7 2/20 0.65
RCE1 Q9Y256 1/20 0.65
ACHE P22303 5/20 0.61
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 2/20 0.60
HPGD P15428 1/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
POLB P06746 2/20 0.59
MAOB P27338 4/20 0.59
MIF P14174 1/20 0.58
MAOA P21397 1/20 0.57

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
SCHEMBL24045270 0.88 SLC26A3 (0.74) SLC26A3CTDSP1RCE1ACHEKDM4E
SCHEMBL26687589 0.82 SLC26A3 (1.00) SLC26A3CTDSP1MEN1KMT2A
SCHEMBL30154899 0.82 SLC26A3 (1.00) SLC26A3CTDSP1MEN1KMT2A
SCHEMBL18095309 0.79 CA12 (0.69) CTDSP1KDM4EALDH1A1HPGDMEN1
SCHEMBL20554014 0.77 CA12 (0.83) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL10681805 0.77 KDM4E (0.64) CTDSP1KDM4EALDH1A1HPGDMEN1
SCHEMBL7432074 0.75 ACHE (1.00) ACHEMAOBMAOA
SCHEMBL26434315 0.75 ALDH1A1 (1.00) CTDSP1ACHEKDM4EALDH1A1HPGD
SCHEMBL5617624 0.75 MAOB (1.00) ACHEMAOBMAOA
SCHEMBL26434307 0.75 ALDH1A1 (0.84) KDM4EALDH1A1HPGDMEN1KMT2A

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-11591304-B2 SLC26A3 inhibitors and use thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-02-28 US disclosed
US-20210363123-A1 SLC26A3 INHIBITORS AND USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-11-25 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 (2 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-20210363123-A1 SLC26A3 INHIBITORS AND USE THEREOF SLC26A3, SLC10A2, SLC10A6 SLC26A3 1/4885CTDSP1 3224/4885RCE1 4524/4885
US-11591304-B2 SLC26A3 inhibitors and use thereof SLC26A3, SLC10A2, SLC10A6 SLC26A3 1/4885CTDSP1 3224/4885RCE1 4524/4885

“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.