SCHEMBL12410368

SCHEMBL12410368

CCCOCC(COCC(COCC(COCCC)OCCC)OCCC)OCCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 1/20 0.45
LPAR1 Q92633 9/20 0.43
LPAR3 Q9UBY5 9/20 0.43
LPAR2 Q9HBW0 6/20 0.43
USP2 O75604 1/20 0.39
HTT P42858 1/20 0.38
DNM1 Q05193 1/20 0.37
TLR2 O60603 2/20 0.33
PRKD3 O94806 1/20 0.33
PRKCG P05129 1/20 0.33
PRKCB P05771 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCH P24723 1/20 0.33
PRKCI P41743 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCZ Q05513 1/20 0.33
PRKCD Q05655 1/20 0.33
PRKD1 Q15139 1/20 0.33

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
SCHEMBL14616857 1.00 HSD17B10 (0.48) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL14616848 1.00 HSD17B10 (0.48) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL209403 0.97 HSD17B10 (0.50) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL14616846 0.93 HSD17B10 (0.43) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL14616845 0.93 HSD17B10 (0.43) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL16473876 0.90 HSD17B10 (0.44) HSD17B10TDP1LPAR1LPAR3LPAR2
Ether SCHEMBL11844631 0.90 HSD17B10 (0.44) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL14616851 0.89 HSD17B10 (0.40) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL23408864 0.87 HSD17B10 (0.46) HSD17B10TDP1LPAR1LPAR3LPAR2
SCHEMBL14870365 0.87 LPAR1 (0.38) HSD17B10TDP1LPAR1LPAR3LPAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9682153-B2 Polymer conjugates of therapeutic peptides NEKTAR THERAPEUTICS (US) 2017-06-20 US disclosed
US-9517278-B2 Compound and photoacoustic imaging contrast medium containing the compound CANON KABUSHIKI KAISHA (JP) 2016-12-13 US disclosed
US-9446139-B2 Polymer-based compositions and conjugates of HIV entry inhibitors NEKTAR THERAPEUTICS (US) 2016-09-20 US disclosed
US-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2016-01-28 US disclosed
US-20150165071-A1 COMPOUND AND PHOTOACOUSTIC IMAGING CONTRAST MEDIUM CONTAINING THE COMPOUND CANON KABUSHIKI KAISHA (JP) 2015-06-18 US disclosed
US-8636994-B2 Polymer-based compositions and conjugates of antimicrobial agents NEKTAR THERAPEUTICS (US) 2014-01-28 US disclosed
US-8580919-B2 Polymer conjugates of GLP-1 NEKTAR THERAPEUTICS (US) 2013-11-12 US disclosed
US-20130195839-A1 Polymer-Based Compositions and Conjugates of Antimicrobial Agents NAKTAR THERAPEUTICS (US) 2013-08-01 US disclosed
US-8420068-B2 Polymer-based compositions and conjugates of antimicrobial agents NEKTAR THERAPEUTICS (US) 2013-04-16 US disclosed
US-20130059360-A1 POLYMER-BASED COMPOSITIONS AND CONJUGATES OF ANTIMICROBIAL AGENTS NEKTAR THERAPEUTICS (US) 2013-03-07 US disclosed
US-8273339-B2 Polymer-based compositions and conjugates of antimicrobial agents NEKTAR THERAPEUTICS (US) 2012-09-25 US disclosed
US-20110171165-A1 POLYMER CONJUGATES OF OPIOID GROWTH FACTOR PEPTIDES NEKTAR THERAPEUTICS 2011-07-14 US disclosed
US-20110171160-A1 POLYMER CONJUGATES OF KISS1 PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110171162-A1 POLYMER CONJUGATES OF THYMOSIN ALPHA 1 PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110171163-A1 POLYMER CONJUGATES OF ZICONOTIDE PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110165113-A1 POLYMER CONJUGATES OF V681-LIKE PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 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 (9 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-20110171160-A1 POLYMER CONJUGATES OF KISS1 PEPTIDES KISS1R, PROKR1, NGLY1 HSD17B10 3761/4885TDP1 2859/4885LPAR1 1267/4885
US-20110171163-A1 POLYMER CONJUGATES OF ZICONOTIDE PEPTIDES NGLY1, VIP, IAPP HSD17B10 3929/4885TDP1 4342/4885LPAR1 2071/4885
US-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP HSD17B10 4085/4885TDP1 2854/4885LPAR1 2751/4885
US-20130195839-A1 Polymer-Based Compositions and Conjugates of Antimicrobial Agents DDOST, CLSPN, DAD1 HSD17B10 3373/4885TDP1 2614/4885LPAR1 3997/4885
US-20110171162-A1 POLYMER CONJUGATES OF THYMOSIN ALPHA 1 PEPTIDES TMSB4X, TMSB10, TAP1 HSD17B10 3960/4885TDP1 901/4885LPAR1 4180/4885
US-20110165113-A1 POLYMER CONJUGATES OF V681-LIKE PEPTIDES NGLY1, VIP, DNPEP HSD17B10 4622/4885TDP1 3255/4885LPAR1 3365/4885
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE DNPEP, VIP, PTMS HSD17B10 4669/4885TDP1 3248/4885LPAR1 2940/4885
US-20110171165-A1 POLYMER CONJUGATES OF OPIOID GROWTH FACTOR PEPTIDES OGFR, OGFRL1, OPRL1 HSD17B10 3602/4885TDP1 4445/4885LPAR1 2276/4885
US-20150165071-A1 COMPOUND AND PHOTOACOUSTIC IMAGING CONTRAST MEDIUM CONTAINING THE COMPOUND CLTB, PAM, CLTA HSD17B10 3323/4885TDP1 4870/4885LPAR1 282/4885

“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.