SCHEMBL3484553

SCHEMBL3484553

CCCCCOc1ccccc1/C=C/C(CCc1ccc(C(=O)O)cc1)Cc1ccc(C(=O)O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 6/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
PPARG P37231 3/20 0.42
PTGES O14684 2/20 0.42
ALOX5 P09917 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
PLA2G4B P0C869 1/20 0.42
MEN1 O00255 1/20 0.42
RARA P10276 1/20 0.42
MTOR P42345 1/20 0.42
PTGER1 P34995 1/20 0.42
PTGER4 P35408 1/20 0.42
PTGER3 P43115 1/20 0.42
PTGER2 P43116 1/20 0.42
KDM4E B2RXH2 1/20 0.41
PSMD14 O00487 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL3484556 1.00 RARB (0.43) RARBTP53TSHRPPARGPTGES
SCHEMBL3484802 0.99 TP53 (0.44) RARBTP53TSHRALDH1A1MAPT
SCHEMBL3484751 0.99 TP53 (0.44) RARBTP53TSHRALDH1A1MAPT
SCHEMBL3484753 0.99 TP53 (0.44) RARBTP53TSHRALDH1A1MAPT
SCHEMBL3484798 0.99 TP53 (0.44) RARBTP53TSHRALDH1A1MAPT
SCHEMBL3484545 0.97 PPARG (0.43) RARBTP53TSHRPPARGPTGES
SCHEMBL3484551 0.97 PPARG (0.43) RARBTP53TSHRPPARGPTGES
SCHEMBL8241509 0.95 TP53 (0.41) RARBTP53TSHRPPARGPTGES
SCHEMBL3485367 0.94 KMT2A (0.43) PPARGPTGESALOX5ALDH1A1MAPT
SCHEMBL3485369 0.94 KMT2A (0.43) PPARGPTGESALOX5ALDH1A1MAPT

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 7 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
WO-2007045433-A1 DICARBOXYLIC ACID DERIVATIVES AND THEIR USE BAYER HEALTHCARE AG (DE) 2007-04-26 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-20100029772-A1 Dicarboxylic Acid Derivatives and their Use PC, SLC25A1, GOT2 RARB 1092/4885TP53 2351/4885TSHR 4540/4885

“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.