SCHEMBL14727910

SCHEMBL14727910

O=Cc1ccc(C(=O)NCCSSCCC(=O)ON2C(=O)CCC2=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ NR1H4 Q96RI1 1/20 0.36
▸ HDAC6 Q9UBN7 4/20 0.35
▸ ALDH1A1 P00352 5/20 0.34
▸ SMN1; SMN2 Q16637 5/20 0.34
▸ HDAC1 Q13547 3/20 0.34
▸ NPC1 O15118 4/20 0.33
▸ RAB9A P51151 4/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ HDAC8 Q9BY41 2/20 0.33
▸ NFKB1 P19838 2/20 0.33
▸ NFKB2 Q00653 2/20 0.33
▸ RELA Q04206 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL17615144 0.83 SMN1; SMN2 (0.42) MEN1KMT2AEPHX2NR1H4HDAC6
SCHEMBL18384364 0.83 SMN1; SMN2 (0.44) MEN1KMT2AEPHX2NR1H4HDAC6
SCHEMBL16192938 0.79 KMT2A (0.40) MEN1KMT2AHDAC6ALDH1A1SMN1; SMN2
SCHEMBL43720 0.75 TSHR (0.34) —
SCHEMBL14730974 0.74 EPHX2 (0.46) EPHX2NR1H4ALDH1A1SMN1; SMN2NPC1
SCHEMBL16784522 0.74 LMNA (0.47) EPHX2NR1H4ALDH1A1SMN1; SMN2HDAC1
SCHEMBL16784533 0.74 EPHX2 (0.41) EPHX2NR1H4HDAC6ALDH1A1SMN1; SMN2
SCHEMBL30483144 0.73 ALDH1A1 (0.36) MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL19662527 0.71 MAPK1 (0.46) MEN1KMT2AHDAC6ALDH1A1SMN1; SMN2
SCHEMBL768869 0.71 TSHR (0.45) KMT2AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020141930-A1 DRUG DELIVERY SYSTEM USING PH-DEPENDENT CELL-PENETRATING PEPTIDES, AND COMPOSITE THEREOF WITH DRUG 김성천 2020-07-09 — — WO disclosed
US-9045750-B2 Humanized lewis-Y specific antibody-based delivery of dicer substrate siRNA (D-siRNA) against STAT3 MA YUELONG (US) 2015-06-02 — — US disclosed
US-9045750-B2 Humanized lewis-Y specific antibody-based delivery of dicer substrate siRNA (D-siRNA) against STAT3 MA YUELONG (US) 2015-06-02 — — US disclosed
US-20130052731-A1 HUMANIZED LEWIS-Y SPECIFIC ANTIBODY-BASED DELIVERY OF DICER SUBSTRATE siRNA (D-siRNA) AGAINST STAT3 MA YUELOG (US) 2013-02-28 — — US disclosed
US-20130052731-A1 HUMANIZED LEWIS-Y SPECIFIC ANTIBODY-BASED DELIVERY OF DICER SUBSTRATE siRNA (D-siRNA) AGAINST STAT3 MA YUELOG (US) 2013-02-28 — — 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 (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-20130052731-A1 HUMANIZED LEWIS-Y SPECIFIC ANTIBODY-BASED DELIVERY OF DICER SUBSTRATE siRNA (D-siRNA) AGAINST STAT3 AGO2, HNRNPH3, HCLS1 MEN1 2736/4885KMT2A 337/4885EPHX2 2884/4885

“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.

Send feedback