SCHEMBL12394685

SCHEMBL12394685

CC(NC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(C=O)c1ccccc1-2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.40
SUV39H2 Q9H5I1 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MMP8 P22894 2/20 0.40
MMP3 P08254 1/20 0.40
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 1/20 0.38
RCE1 Q9Y256 1/20 0.38
HDAC4 P56524 2/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC3 O15379 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC9 Q9UKV0 1/20 0.37
HDAC5 Q9UQL6 1/20 0.37

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
SCHEMBL3006400 0.87 IDO1 (0.45) HDAC1HDAC3HDAC2HDAC8HDAC6
SCHEMBL12394690 0.84 MEN1 (0.41) JAK2SUV39H2MEN1KMT2AMMP8
SCHEMBL1115122 0.81 CA12 (0.47) KDM4EALDH1A1HDAC1HDAC3HDAC2
SCHEMBL12394688 0.77 CYP1A2 (0.55) MEN1KMT2AMMP8MMP3KDM4E
SCHEMBL29481024 0.76 SMN1; SMN2 (0.51) JAK2SUV39H2MEN1KMT2AMMP8
SCHEMBL31323267 0.75 HDAC8 (0.51) JAK2MEN1KMT2AALDH1A1HDAC4
SCHEMBL13258134 0.75 HDAC8 (0.51) JAK2MEN1KMT2AALDH1A1HDAC4
SCHEMBL13258279 0.75 HDAC8 (0.51) JAK2MEN1KMT2AALDH1A1HDAC4
SCHEMBL1752669 0.73 TAAR1 (0.55) JAK2MEN1KMT2AHDAC4HDAC1
SCHEMBL1752666 0.72 HDAC4 (0.65) JAK2HDAC4HDAC1HDAC3HDAC7

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
US-9956295-B2 Reversible pegylated drugs YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2018-05-01 US disclosed
US-20160324975-A1 REVERSIBLE PEGYLATED DRUGS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2016-11-10 US disclosed
US-9433683-B2 Reversible pegylated drugs YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2016-09-06 US disclosed
US-20160000927-A1 REVERSIBLE PEGYLATED DRUGS YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2016-01-07 US disclosed
US-9119883-B2 Reversible pegylated drugs YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2015-09-01 US disclosed
US-20150057219-A1 REVERSIBLE PEGYLATED DRUGS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2015-02-26 US disclosed
US-8877709-B2 Reversible pegylated drugs YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2014-11-04 US disclosed
US-8735350-B2 Reversible pegylated drugs YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2014-05-27 US disclosed
US-20140121352-A1 REVERSIBLE PEGYLATED DRUGS YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2014-05-01 US disclosed
US-8575102-B2 Conjugates having a releasable linkage NEKTAR THERAPEUTICS (US) 2013-11-05 US disclosed
US-20130116175-A1 REVERSIBLE PEGYLATED DRUGS YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 2013-05-09 US disclosed
US-8343910-B2 Reversible pegylated drugs YEDA RESEARCH DEVELOPMENT CO., LTD (IL) 2013-01-01 US disclosed
US-20110190209-A1 CONJUGATES HAVING A RELEASABLE LINKAGE NEKTAR THERAPEUTICS (US) 2011-08-04 US disclosed
US-20100041867-A1 REVERSIBLE PEGYLATED DRUGS Yeda Reserch and Development Co., Ltd. (IL) 2010-02-18 US disclosed
WO-2010014258-A2 CONJUGATES HAVING A RELEASABLE LINKAGE NEKTAR THERAPEUTICS AL, CORPORATION (US) 2010-02-04 WO disclosed
US-7585837-B2 derivatization of the drug with 9-fluorenylmethoxycarbonyl (Fmoc) or 2-sulfo-9-fluorenylmethoxycarbonyl (FMS) removable under mild basic conditions by attaching a protein or polymer carrier to derivatized drug molecule,such carrier serving for delivery of the drug YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2009-09-08 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 (7 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-20150057219-A1 REVERSIBLE PEGYLATED DRUGS PTMS, FIBP, FLT3 JAK2 656/4885SUV39H2 3909/4885MEN1 4429/4885
US-20100041867-A1 REVERSIBLE PEGYLATED DRUGS PTMS, FIBP, FLT3 JAK2 656/4885SUV39H2 3909/4885MEN1 4429/4885
US-20110190209-A1 CONJUGATES HAVING A RELEASABLE LINKAGE CD44, GUSB, MSN JAK2 3515/4885SUV39H2 1451/4885MEN1 1346/4885
US-20140121352-A1 REVERSIBLE PEGYLATED DRUGS PTMS, FIBP, FLT3 JAK2 656/4885SUV39H2 3909/4885MEN1 4429/4885
US-20130116175-A1 REVERSIBLE PEGYLATED DRUGS PTMS, FIBP, FLT3 JAK2 656/4885SUV39H2 3909/4885MEN1 4429/4885
US-20160324975-A1 REVERSIBLE PEGYLATED DRUGS PTMS, FIBP, FLT3 JAK2 656/4885SUV39H2 3909/4885MEN1 4429/4885
US-20160000927-A1 REVERSIBLE PEGYLATED DRUGS PTMS, FIBP, FLT3 JAK2 656/4885SUV39H2 3909/4885MEN1 4429/4885

“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.