SCHEMBL3426708

SCHEMBL3426708

O=C(O)COCC1CCC=CO1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 14/20 0.35
PTGDR Q13258 5/20 0.35
PTGER1 P34995 1/20 0.31
PTGER4 P35408 1/20 0.31
PTGER3 P43115 1/20 0.31
PTGER2 P43116 1/20 0.31

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
SCHEMBL10944570 0.82 MAPK1 (0.35)
SCHEMBL11053945 0.78 TSHR (0.40)
SCHEMBL11636230 0.77 CYP1A2 (0.33)
SCHEMBL8515614 0.75 SMN1; SMN2 (0.33)
SCHEMBL260743 0.75 NLRP3 (0.36)
SCHEMBL259449 0.75 NLRP3 (0.36)
SCHEMBL8428847 0.75 ALDH1A1 (0.44)
SCHEMBL4304520 0.72 TP53 (0.37)
SCHEMBL10335808 0.72 NPSR1 (0.33)
SCHEMBL1686047 0.71 SMN1; SMN2 (0.33)

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-3215513-B1 FUNCTIONALIZED MORPHOLINYL ANTHRACYCLINE DERIVATIVES NERVIANO MEDICAL SCIENCES SRL (IT) 2019-05-08 EP disclosed
US-9826129-B2 Near-infrared-ray-absorbing composition, near-infrared-ray cut filter using same, manufacturing method therefor, camera module, and manufacturing method therefor FUJIFILM CORPORATION (JP) 2017-11-21 US disclosed
US-9826129-B2 Near-infrared-ray-absorbing composition, near-infrared-ray cut filter using same, manufacturing method therefor, camera module, and manufacturing method therefor FUJIFILM CORPORATION (JP) 2017-11-21 US disclosed
US-20170312290-A1 FUNCTIONALIZED MORPHOLINYL ANTHRACYCLINE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2017-11-02 US disclosed
EP-3215513-A1 FUNCTIONALIZED MORPHOLINYL ANTHRACYCLINE DERIVATIVES Nerviano Medical Sciences S.r.l. (IT) 2017-09-13 EP disclosed
US-9695240-B2 Anthracycline derivative conjugates, process for their preparation and their use as antitumor compounds GENENTECH, INC. (US) 2017-07-04 US disclosed
WO-2016071418-A1 FUNCTIONALIZED MORPHOLINYL ANTHRACYCLINE DERIVATIVES NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2016-05-12 WO disclosed
US-20160037034-A1 NEAR-INFRARED-RAY-ABSORBING COMPOSITION, NEAR-INFRARED-RAY CUT FILTER USING SAME, MANUFACTURING METHOD THEREFOR, CAMERA MODULE, AND MANUFACTURING METHOD THEREFOR FUJIFILM CORPORATION (JP) 2016-02-04 US disclosed
US-20160037034-A1 NEAR-INFRARED-RAY-ABSORBING COMPOSITION, NEAR-INFRARED-RAY CUT FILTER USING SAME, MANUFACTURING METHOD THEREFOR, CAMERA MODULE, AND MANUFACTURING METHOD THEREFOR FUJIFILM CORPORATION (JP) 2016-02-04 US disclosed
US-20150051380-A1 ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS GENENTECH, INC. (US) 2015-02-19 US disclosed
EP-2303332-B1 ANTHRACYCLINE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS GENENTECH INC (US) 2014-12-31 EP disclosed
US-8900589-B2 Anthracycline derivative conjugates, process for their preparation and their use as antitumor compounds GENETECH, INC. (US) 2014-12-02 US disclosed
US-8389697-B2 Anthracycline derivative conjugates, process for their preparation and their use as antitumor compounds GENENTECH, INC. (US) 2013-03-05 US disclosed
US-20120130059-A1 ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS BERIA ITALO (IT) 2012-05-24 US disclosed
US-20100034837-A1 ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS GENENTECH, INC. 2010-02-11 US disclosed
WO-2010009124-A2 ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS GENENTECH, INC. (US) 2010-01-21 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 (5 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-20160037034-A1 NEAR-INFRARED-RAY-ABSORBING COMPOSITION, NEAR-INFRARED-RAY CUT FILTER USING SAME, MANUFACTURING METHOD THEREFOR, CAMERA MODULE, AND MANUFACTURING METHOD THEREFOR FAR1, SLC39A11, NOTUM PTGIR 2696/4885PTGDR 4655/4885PTGER1 2878/4885
US-20170312290-A1 FUNCTIONALIZED MORPHOLINYL ANTHRACYCLINE DERIVATIVES CCNY, BCR, CCNB3 PTGIR 4703/4885PTGDR 2278/4885PTGER1 4688/4885
US-20150051380-A1 ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS MRPL21, BCR, MYD88 PTGIR 4774/4885PTGDR 4104/4885PTGER1 4609/4885
US-20100034837-A1 ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS MRPL21, BCR, MYD88 PTGIR 4774/4885PTGDR 4104/4885PTGER1 4609/4885
US-20120130059-A1 ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS MRPL21, BCR, MYD88 PTGIR 4774/4885PTGDR 4104/4885PTGER1 4609/4885

“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.