SCHEMBL1589935

SCHEMBL1589935

Cc1ccccc1-c1ccc(-c2ccccc2C)c(CC(=O)O)c1CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.50
GAA P10253 2/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CASP1 P29466 1/20 0.45
CASP7 P55210 1/20 0.45
AKR1B1 P15121 2/20 0.43
PPARG P37231 1/20 0.43
PPARA Q07869 1/20 0.43
PTGS2 P35354 2/20 0.42
HPGD P15428 1/20 0.42
FFAR1 O14842 3/20 0.42
MYC P01106 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
SMN1; SMN2 Q16637 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
SCHEMBL10715190 0.83 KDM4E (0.43) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL9447453 0.81 PTGS2 (0.54) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL11899242 0.79 PTGS1 (0.50) KDM4EGAAMAPTMEN1KMT2A
Bicarbonate SCHEMBL8972762 0.79 MYC (0.54) KDM4EALDH1A1PPARGPPARAHPGD
SCHEMBL19475173 0.78 PTGS2 (0.55) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL1004574 0.77 KDM4E (0.58) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL28792792 0.76 MCL1 (0.51) AKR1B1PPARGPPARAPTGS2FFAR1
SCHEMBL1589599 0.75 DPP4 (0.41) GAACYP1A2CYP3A4CYP2C19PPARG
SCHEMBL10711686 0.75 KDM4E (0.42) KDM4EGAAMAPTMEN1KMT2A
SCHEMBL6669751 0.75 KDM4E (0.68) KDM4EGAAMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2276723-B1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-01-27 EP disclosed
CN-102026958-B Compounds for electronic devices MERCK PATENT GMBH 2014-08-20 CN disclosed
US-8766001-B2 Compounds for electronic devices MERCK PATENT GMBH (DE) 2014-07-01 US disclosed
US-20110092701-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-04-21 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-20110092701-A1 COMPOUNDS FOR ELECTRONIC DEVICES SLCO4C1, SLCO2A1, TOE1 KDM4E 2999/4885GAA 2036/4885MAPT 1230/4885

“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.