SCHEMBL23306643

SCHEMBL23306643

C=CC(=O)n1c2ccccc2c2cc(C(=O)O)ccc21

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.61
▸ ALDH1A1 P00352 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ PTGER4 P35408 6/20 0.43
▸ LMNA P02545 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ HTT P42858 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ PTGDR2 Q9Y5Y4 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ CNR2 P34972 1/20 0.40
▸ GRIN2D O15399 1/20 0.40
▸ GRIN2A Q12879 1/20 0.40
▸ GRIN2C Q14957 1/20 0.40

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
SCHEMBL31662502 1.00 KDM4E (0.61) KDM4EALDH1A1HPGDPTGER4LMNA
SCHEMBL32689427 0.84 POLB (0.55) KDM4EALDH1A1HPGDLMNAMAPT
SCHEMBL811819 0.84 POLB (0.55) KDM4EALDH1A1HPGDLMNAMAPT
SCHEMBL22102656 0.80 TSPO (0.47) KDM4EPTGER4LMNAPOLBCNR2
SCHEMBL23318342 0.79 PTGER4 (0.49) KDM4EALDH1A1HPGDPTGER4LMNA
SCHEMBL23318385 0.79 CNR2 (0.50) CNR2
SCHEMBL31416092 0.78 KDM4E (0.69) KDM4EALDH1A1HPGDPTGER4MAPT
SCHEMBL21760735 0.78 KDM4E (0.69) KDM4EALDH1A1HPGDPTGER4MAPT
SCHEMBL23318279 0.78 RORC (0.44) KDM4EPTGDR2CNR2
SCHEMBL23318377 0.77 POLB (0.39) KDM4EALDH1A1HPGDLMNAMAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145782-A1 p53 MODULATORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-05-11 — — US disclosed
EP-4051283-A1 P53 MODULATORS AND USES THEREOF The Regents of the University of California (US) 2022-09-07 — — EP disclosed
WO-2021087096-A1 P53 MODULATORS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-05-06 — — WO 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-20230145782-A1 p53 MODULATORS AND USES THEREOF TP53, TP53BP1, MDM2 KDM4E 3329/4885ALDH1A1 2724/4885HPGD 604/4885

“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.

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