SCHEMBL25793900

SCHEMBL25793900

O=C(O)c1ccc(CC2CCCCC2)c(C(=O)OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPM1D O15297 3/20 0.51
ALDH1A1 P00352 4/20 0.47
LMNA P02545 2/20 0.44
TDP1 Q9NUW8 2/20 0.43
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HPGD P15428 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
SCHEMBL27741282 0.81 PPM1D (0.50) PPM1DKMT2A
SCHEMBL28048040 0.79 PPM1D (0.48) PPM1DALDH1A1KMT2A
SCHEMBL4941110 0.79 ALDH1A1 (0.68) ALDH1A1LMNATDP1SLC6A2SLC6A3
SCHEMBL4938474 0.78 ALDH1A1 (0.71) ALDH1A1LMNATDP1SLC6A2SLC6A3
SCHEMBL28105519 0.77 PPM1D (0.45) PPM1DALDH1A1KMT2A
SCHEMBL5834481 0.76 ALDH1A1 (0.62) ALDH1A1LMNATDP1SLC6A2SLC6A3
SCHEMBL5834914 0.76 ALDH1A1 (0.71) ALDH1A1LMNATDP1SLC6A2SLC6A3
SCHEMBL3853181 0.74 PPM1D (0.51) PPM1DKMT2A
SCHEMBL7298560 0.74 PPM1D (0.53) PPM1DALDH1A1KMT2ANPC1RAB9A
SCHEMBL28047118 0.74 KDM4E (0.42) PPM1DALDH1A1KMT2AMAPT

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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-06-22 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-20230192607-A1 TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF TEAD1, TEAD4, TEAD2 PPM1D 1382/4885ALDH1A1 3323/4885LMNA 2451/4885

“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.