SCHEMBL6623769

SCHEMBL6623769

CCOC(=O)CCCCCCCCC(C)=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
DGKA P23743 1/20 0.54
ALDH1A1 P00352 3/20 0.53
ALOX15 P16050 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
TSHR P16473 2/20 0.53
CYP3A4 P08684 1/20 0.53
HSD17B10 Q99714 1/20 0.53
GAA P10253 2/20 0.52
PAM P19021 2/20 0.48
PAOX Q6QHF9 1/20 0.48
MGAM O43451 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
USP2 O75604 1/20 0.47
KMT2A Q03164 2/20 0.47
NR1I2 O75469 1/20 0.47
PGR P06401 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
PTGS2 P35354 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
SCHEMBL6823809 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL10534701 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL28663838 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL16022550 1.00 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL8417337 0.98 CYP1A2 (0.61) CYP1A2DGKAALDH1A1ALOX15TDP1
Ethylene SCHEMBL11466234 0.96 CYP1A2 (0.55) CYP1A2DGKAALDH1A1ALOX15TDP1
2-Nonanone SCHEMBL28983324 0.94 DGKA (0.64) CYP1A2DGKAALDH1A1TSHRPAM
SCHEMBL723390 0.93 CYP1A2 (0.61) CYP1A2DGKAALDH1A1ALOX15TDP1
Ethane SCHEMBL11195854 0.91 CYP1A2 (0.59) CYP1A2DGKAALDH1A1ALOX15TDP1
SCHEMBL6055406 0.91 CYP1A2 (0.70) CYP1A2DGKAALDH1A1ALOX15TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1264836-B1 Processes for the preparation of indolopyrrolocarbazole derivatives BANYU PHARMA CO LTD (JP) 2004-12-01 EP disclosed
US-20030130342-A1 Glycoprotein llb/llla antagonists FISHER MATTHEW J (US) 2003-07-10 US disclosed
EP-0804431-B9 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 2003-01-02 EP disclosed
EP-1264836-A1 Processes for the preparation of indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-12-11 EP disclosed
US-6448269-B1 SUCH AS 6-(N-(4-(AMINOIMINOMETHYL)BENZOYL)AMINO)-3,4-DIHYDRO-4,4-DIMETHYL-2H-1 -BENZOPYRAN-2-YL)ACETIC ACID; INHIBITING PLATELET AGGREGATION OR FIBRINOGEN BINDING OR PREVENTING THROMBOSIS ELI LILLY AND COMPANY 2002-09-10 US disclosed
EP-0804431-B1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 2002-07-24 EP disclosed
US-6020362-A ANTICOAGULANTS ELI LILLY AND COMPANY (US) 2000-02-01 US disclosed
US-5922860-A Antitumor indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-07-13 US disclosed
US-5804564-A Antitumor indolopyrrolocarbazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-09-08 US disclosed
EP-0804431-A4 GLYCOPROTEIN IIb/IIIa ANTAGONISTS LILLY CO ELI (US) 1998-04-29 EP disclosed
US-5731324-A Glycoprotein IIb/IIIa antagonists ELI LILLY AND COMPANY (US) 1998-03-24 US disclosed
EP-0804431-A1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS ELI LILLY AND COMPANY (US) 1997-11-05 EP disclosed
EP-0760375-A1 ANTITUMOR INDOLOPYPROLOCARBAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 1997-03-05 EP disclosed
WO-1996022288-A1 GLYCOPROTEIN IIb/IIIa ANTAGONISTS ELI LILLY AND COMPANY (US) 1996-07-25 WO disclosed
US-4997836-A Inhibitor of platelet activating factor TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-03-05 US disclosed
EP-0368670-A1 Trisubstituted piperazine compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1990-05-16 EP 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-20030130342-A1 Glycoprotein llb/llla antagonists SELL, SELPLG, LY96 CYP1A2 3254/4885DGKA 2719/4885ALDH1A1 1693/4885

“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.