SCHEMBL2628161

SCHEMBL2628161

CC(C)(c1ccc(Oc2ccc(C(=O)c3ccc(Cl)cc3)cc2)cc1)c1cccc(C(C)(C)c2ccc(Oc3ccc(C(=O)c4ccc(Cl)cc4)cc3)cc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.51
PPARA Q07869 3/20 0.50
PPARG P37231 2/20 0.50
HPGD P15428 2/20 0.50
FABP2 P12104 1/20 0.50
SLC22A12 Q96S37 1/20 0.50
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
LMNA P02545 2/20 0.45
CYP2C9 P11712 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
USP2 O75604 1/20 0.45
ABCB11 O95342 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
MAPT P10636 1/20 0.45
ADRB3 P13945 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL14030864 0.96 ELANE (0.48) ELANEPPARAPPARGHPGDFABP2
SCHEMBL13252904 0.95 HPGD (0.47) ELANEPPARAPPARGHPGDFABP2
SCHEMBL2628122 0.95 HPGD (0.60) ELANEPPARAPPARGHPGDFABP2
SCHEMBL13309960 0.95 ELANE (0.47) ELANEPPARAPPARGHPGDFABP2
SCHEMBL822836 0.91 ELANE (0.59) ELANEPPARAPPARGHPGDFABP2
SCHEMBL13250806 0.91 ELANE (0.59) ELANEPPARAPPARGHPGDFABP2
SCHEMBL15760406 0.87 MMP13 (0.49) ELANEESR1ESR2LMNACYP2C9
SCHEMBL16355302 0.87 ALDH1A1 (0.48) HPGDESR1ESR2LMNAMEN1
SCHEMBL15760405 0.87 MMP13 (0.49) ELANEESR1ESR2LMNACYP2C9
SCHEMBL14354267 0.86 MAPT (0.49) ELANEHPGDESR1ESR2CYP2C9

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
US-8431676-B2 Aromatic compound and sulfonated polyarylene polymer JSR CORPORATION (JP) 2013-04-30 US disclosed
US-8163406-B2 Membrane-electrode assembly for solid polymer electrolyte fuel cell HONDA MOTOR CO., LTD. (JP) 2012-04-24 US disclosed
US-20100174042-A1 AROMATIC COMPOUND AND SULFONATED POLYARYLENE POLYMER JSR CORPORATION (JP) 2010-07-08 US disclosed
US-20080160381-A1 MEMBRANE-ELECTRODE ASSEMBLY FOR SOLID POLYMER ELECTROLYTE FUEL CELL HONDA MOTOR CO., LTD. (JP) 2008-07-03 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-20100174042-A1 AROMATIC COMPOUND AND SULFONATED POLYARYLENE POLYMER SCO2, CBR1, CNOT1 ELANE 2892/4885PPARA 1699/4885PPARG 2007/4885

“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.