SCHEMBL2425346

SCHEMBL2425346

N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC(=O)CCCC(=O)OC(=O)[C@@H](N)Cc1c[nH]c2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.64
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
LMNA P02545 2/20 0.64
KDM4E B2RXH2 2/20 0.64
MPO P05164 1/20 0.64
TSHR P16473 1/20 0.64
BLM P54132 1/20 0.64
PMP22 Q01453 1/20 0.64
HIF1A Q16665 1/20 0.64
TACR1 P25103 2/20 0.58
ALDH1A1 P00352 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
HTR2A P28223 2/20 0.51
ADRB1 P08588 1/20 0.51

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
SCHEMBL21248618 0.95 MAPT (0.62) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL29701304 0.93 MAPT (0.58) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL28542188 0.93 MAPT (0.58) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL28910765 0.92 KDM4E (0.57) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL29701302 0.91 MAPT (0.62) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL598475 0.91 MAPT (0.62) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL28543938 0.91 MAPT (0.62) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL528960 0.91 KDM4E (0.56) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL29701308 0.91 KDM4E (0.56) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL28546877 0.91 KDM4E (0.56) MAPTMEN1KMT2ALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8025901-B2 Bifunctional-modified hydrogels WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2011-09-27 US disclosed
US-20100209509-A1 BIFUNCTIONAL-MODIFIED HYDROGELS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2010-08-19 US disclosed
US-7615593-B2 Comprises interpenetrating polymer network/matrix (of collagen and/or gelatin) modified with endcapped polyalkylene glycol; drug delivery; for incorporation into bandages, surgical and dental wound packing material, diapers and catamenial devices WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-11-10 US disclosed
US-20060100369-A1 Bifunctional-modified hydrogels KAO WEIYUAN J 2006-05-11 US disclosed
US-20050276858-A1 Bifunctional-modified hydrogels NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-12-15 US disclosed
EP-1423093-A4 BIFUNCTIONAL-MODIFIED HYDROGELS WISCONSIN ALUMNI RES FOUND (US) 2005-11-30 EP disclosed
EP-1423093-A2 BIFUNCTIONAL-MODIFIED HYDROGELS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2004-06-02 EP disclosed
US-20030083389-A1 Bifunctional-modified hydrogels NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-05-01 US disclosed
WO-2002085419-A2 BIFUNCTIONAL-MODIFIED HYDROGELS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2002-10-31 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 (3 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-20050276858-A1 Bifunctional-modified hydrogels PCNA, CDC25B, ALG1 MAPT 3743/4885MEN1 3207/4885KMT2A 1670/4885
US-20100209509-A1 BIFUNCTIONAL-MODIFIED HYDROGELS PCNA, CDC25B, ALG1 MAPT 3743/4885MEN1 3207/4885KMT2A 1670/4885
US-20060100369-A1 Bifunctional-modified hydrogels PCNA, CDC25B, ALG1 MAPT 3743/4885MEN1 3207/4885KMT2A 1670/4885

“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.