SCHEMBL25146744

SCHEMBL25146744

CCCc1ccc(-c2cccc(CCC(=O)O)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 14/20 0.65
FFAR4 Q5NUL3 4/20 0.60
AKR1B1 P15121 1/20 0.60
LIPG Q9Y5X9 1/20 0.59
KEAP1 Q14145 1/20 0.53
MCL1 Q07820 1/20 0.52
RXRA P19793 1/20 0.52
RXRB P28702 1/20 0.52
RXRG P48443 1/20 0.52
BCL2 P10415 1/20 0.51

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
SCHEMBL18563482 0.89 FFAR1 (0.67) FFAR1FFAR4AKR1B1LIPGKEAP1
SCHEMBL23512360 0.89 FFAR1 (0.62) FFAR1FFAR4AKR1B1LIPGKEAP1
SCHEMBL7347912 0.85 FFAR1 (0.69) FFAR1FFAR4AKR1B1LIPGKEAP1
SCHEMBL1206832 0.85 KEAP1 (0.61) FFAR1FFAR4KEAP1
SCHEMBL29381971 0.85 FFAR1 (0.69) FFAR1FFAR4AKR1B1LIPGKEAP1
SCHEMBL15238584 0.85 MCL1 (0.49) FFAR1MCL1BCL2
SCHEMBL30671117 0.84 FFAR1 (0.71) FFAR1FFAR4AKR1B1LIPGKEAP1
SCHEMBL12646398 0.84 FFAR1 (0.69) FFAR1FFAR4AKR1B1LIPGKEAP1
SCHEMBL25146340 0.84 FFAR4 (0.59) FFAR1FFAR4AKR1B1LIPGMCL1
SCHEMBL1206798 0.82 L3MBTL1 (0.69) FFAR1FFAR4KEAP1

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-20230117680-A1 CYCLOPHILIN D INHIBITORS AND USES THEREOF THE BROAD INSTITUTE, INC. (US) 2023-04-20 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-20230117680-A1 CYCLOPHILIN D INHIBITORS AND USES THEREOF PPID, PPIF, PPIL1 FFAR1 776/4885FFAR4 2102/4885AKR1B1 41/4885

“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.