SCHEMBL3484798

SCHEMBL3484798

CCCCCCOc1ccccc1/C=C/C(CCc1ccc(C(=O)O)cc1)Cc1ccc(C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
RARB P10826 8/20 0.44
PLA2G4B P0C869 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RARA P10276 1/20 0.44
MAPT P10636 1/20 0.44
MTOR P42345 1/20 0.44
KMT2A Q03164 1/20 0.44
PTPN11 Q06124 1/20 0.43
LTB4R Q15722 1/20 0.42

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
SCHEMBL3484753 1.00 TP53 (0.44) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL3484802 1.00 TP53 (0.44) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL3484751 1.00 TP53 (0.44) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL3484556 0.99 RARB (0.43) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL3484553 0.99 RARB (0.43) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL8241509 0.96 TP53 (0.41) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL3484551 0.96 PPARG (0.43) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL3484545 0.96 PPARG (0.43) TP53TSHRRARBPLA2G4BMEN1
SCHEMBL3485367 0.93 KMT2A (0.43) MEN1ALDH1A1MAPTKMT2A
SCHEMBL3485369 0.93 KMT2A (0.43) MEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940769-B1 DICARBOXYLIC ACID DERIVATIVES AND THEIR USE BAYER IP GMBH (DE) 2016-08-10 EP disclosed
EP-1940769-B1 DICARBOXYLIC ACID DERIVATIVES AND THEIR USE BAYER IP GMBH (DE) 2016-08-10 EP disclosed
US-8609727-B2 Dicarboxylic acid derivatives and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-12-17 US disclosed
US-20100029772-A1 Dicarboxylic Acid Derivatives and their Use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-02-04 US disclosed
US-20100029772-A1 Dicarboxylic Acid Derivatives and their Use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-02-04 US disclosed
US-20100029772-A1 Dicarboxylic Acid Derivatives and their Use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-02-04 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-20100029772-A1 Dicarboxylic Acid Derivatives and their Use PC, SLC25A1, GOT2 TP53 2351/4885TSHR 4540/4885RARB 1092/4885

“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.