SCHEMBL2160898

SCHEMBL2160898

COC(=O)c1ccc(CCC(CO)CCc2ccc(C(=O)OC)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 3/20 0.63
CYP4F2 P78329 2/20 0.61
LOXL2 Q9Y4K0 1/20 0.54
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
HSD17B10 Q99714 2/20 0.49
TP53 P04637 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
ALOX15 P16050 1/20 0.49
ALOX12 P18054 1/20 0.49
CYP2C19 P33261 1/20 0.49
CKS1B P61024 1/20 0.49
SKP2 Q13309 1/20 0.49
HIF1A Q16665 1/20 0.49
MAPT P10636 2/20 0.47
CA1 P00915 3/20 0.47
CA2 P00918 3/20 0.47
TDP1 Q9NUW8 1/20 0.47

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
SCHEMBL3022618 0.92 CYP4A11 (0.58) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL2294619 0.87 CYP4A11 (0.52) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL2653681 0.85 CYP4A11 (0.61) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL8235320 0.84 CYP4A11 (0.49) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL8293519 0.83 CYP4A11 (0.62) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL6656906 0.83 CYP4A11 (0.62) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL2294490 0.83 CYP4A11 (0.48) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL2291702 0.83 CYP4A11 (0.48) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL70185 0.82 CYP4A11 (0.75) CYP4A11CYP4F2LOXL2ALDH1A1HPGD
SCHEMBL31753280 0.81 CYP4A11 (0.60) CYP4A11CYP4F2LOXL2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2142495-B1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BAYER IP GMBH (DE) 2016-04-27 EP disclosed
US-8217063-B2 Lactam-substituted dicarboxylic acids and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-07-10 US disclosed
US-8217063-B2 Lactam-substituted dicarboxylic acids and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-07-10 US disclosed
US-8217063-B2 Lactam-substituted dicarboxylic acids and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-07-10 US disclosed
US-7985876-B2 Substituted dibenzoic acid derivatives and use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-07-26 US disclosed
US-7985876-B2 Substituted dibenzoic acid derivatives and use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-07-26 US disclosed
US-7985876-B2 Substituted dibenzoic acid derivatives and use thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-07-26 US disclosed
US-20100197680-A1 LACTAM-SUBSTITUTED DICARBOXYLIC ACIDS AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-05 US disclosed
US-20100197680-A1 LACTAM-SUBSTITUTED DICARBOXYLIC ACIDS AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-05 US disclosed
US-20100197680-A1 LACTAM-SUBSTITUTED DICARBOXYLIC ACIDS AND USE THEREOF BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2010-08-05 US disclosed
US-20100168240-A1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-07-01 US disclosed
US-20100168240-A1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-07-01 US disclosed
US-20100168240-A1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-07-01 US disclosed
WO-2008119457-A2 LACTAM-SUBSTITUTED DICARBOXYLIC ACIDS AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-10-09 WO disclosed
WO-2008119458-A1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-10-09 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 (2 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-20100168240-A1 SUBSTITUTED DIBENZOIC ACID DERIVATIVES AND USE THEREOF BBOX1, DDC, DDT CYP4A11 158/4885CYP4F2 76/4885LOXL2 2634/4885
US-20100197680-A1 LACTAM-SUBSTITUTED DICARBOXYLIC ACIDS AND USE THEREOF DDO, DDC, BCAT2 CYP4A11 2160/4885CYP4F2 672/4885LOXL2 1834/4885

“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.