SCHEMBL2618704

SCHEMBL2618704

NNC(=O)CCNC(=O)CCSSCCC(=O)NCCC(=O)NN

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.46
KDM5C P41229 1/20 0.46
PHF8 Q9UPP1 1/20 0.46
KDM2A Q9Y2K7 1/20 0.46
LMNA P02545 1/20 0.45
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA9 Q16790 3/20 0.44
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
CTSD P07339 1/20 0.41
TSHR P16473 1/20 0.37
ECE1 P42892 1/20 0.36
ALDH1A1 P00352 3/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
HPGD P15428 2/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL13492303 0.91 LMNA (0.42) KDM4EKDM5CPHF8KDM2ALMNA
SCHEMBL13302374 0.88 ALDH1A1 (0.39) KDM4EKDM5CPHF8KDM2ALMNA
SCHEMBL2618708 0.88 KDM4E (0.43) KDM4EKDM5CPHF8KDM2ALMNA
SCHEMBL1160518 0.87 KDM4E (0.59) KDM4EKDM5CPHF8KDM2ALMNA
SCHEMBL2618703 0.85 KDM4E (0.48) KDM4EKDM5CPHF8KDM2ALMNA
SCHEMBL2618710 0.82 ALDH1A1 (0.44) KDM4EKDM5CPHF8KDM2ACA1
SCHEMBL2618713 0.82 TSHR (0.41) KDM4EKDM5CPHF8KDM2ALMNA
SCHEMBL2618712 0.81 LMNA (0.46) KDM4EKDM5CPHF8KDM2ALMNA
SCHEMBL13302376 0.80 ALDH1A1 (0.47) KDM4EKDM5CPHF8KDM2ACTSD
SCHEMBL6536908 0.78 LMNA (0.54) LMNACA1CA2CA9CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8647670-B2 Biocompatible rapid-gelating hydrogel and associated preparation method of spray BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2014-02-11 US disclosed
US-8647670-B2 Biocompatible rapid-gelating hydrogel and associated preparation method of spray BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2014-02-11 US disclosed
US-8158754-B2 Multiple modified derivatives of gelatin and crosslinked material thereof BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2012-04-17 US disclosed
US-8124757-B2 Thiol-modified macromolecule derivatives and cross-linked materials thereof BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2012-02-28 US disclosed
US-8067636-B2 Dihydrazide compounds, preparation and uses thereof BIOREGEN BIOMEDICAL (SHANGHAI) CO., LTD (CN) 2011-11-29 US disclosed
US-20100152423-A1 THIOL-MODIFIED MACROMOLECULE DERIVATIVES AND CROSS-LINKED MATERIALS THEREOF BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2010-06-17 US disclosed
US-20100144902-A1 BIOCOMPATIBLE RAPID-GELATING HYDROGEL AND ASSOCIATED PREPARATION METHOD OF SPRAY BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2010-06-10 US disclosed
US-20100048952-A1 DIHYDRAZIDE COMPOUNDS, PREPARATION AND USES THEREOF BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2010-02-25 US disclosed
US-20090306345-A1 MULTIPLE MODIFIED DERIVATIVES OF GELATIN AND CROSSLINKED MATERIAL THEREOF BIOREGEN BIOMEDICAL (CHANGZHOU) CO., LTD. (CN) 2009-12-10 US disclosed
EP-2088140-A1 DIHYDRAZIDE COMPOUNDS, PREPARATION AND USES THEREOF Bioregen Biomedical (Shanghai) Co., Ltd. (CN) 2009-08-12 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 (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-20100048952-A1 DIHYDRAZIDE COMPOUNDS, PREPARATION AND USES THEREOF GRHPR, HRH4, HRH2 KDM4E 2190/4885KDM5C 3898/4885PHF8 1071/4885
US-20100144902-A1 BIOCOMPATIBLE RAPID-GELATING HYDROGEL AND ASSOCIATED PREPARATION METHOD OF SPRAY CSTB, CAPG, F12 KDM4E 2989/4885KDM5C 1626/4885PHF8 4283/4885
US-20100152423-A1 THIOL-MODIFIED MACROMOLECULE DERIVATIVES AND CROSS-LINKED MATERIALS THEREOF PTMS, TMT1A, EPCAM KDM4E 2135/4885KDM5C 2657/4885PHF8 2446/4885

“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.