SCHEMBL3628330

SCHEMBL3628330

CCCOP(=O)(OCC)c1cccs1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MMP9 P14780 2/20 0.37
MMP1 P03956 1/20 0.37
MMP3 P08254 1/20 0.37
ADAM17 P78536 1/20 0.37
ADAM9 Q13443 1/20 0.37
ALDH1A1 P00352 5/20 0.36
LMNA P02545 3/20 0.36
GAA P10253 3/20 0.36
KDM4E B2RXH2 2/20 0.36
HTT P42858 1/20 0.36
HDAC1 Q13547 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
KCNH2 Q12809 1/20 0.33
HPGD P15428 3/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 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
SCHEMBL5363394 0.92 TSHR (0.52) TSHRHSD17B10MEN1KMT2AMMP9
SCHEMBL11127876 0.88 LPAR3 (0.40) TSHRHSD17B10MMP9MMP1MMP3
SCHEMBL11128583 0.78 CA12 (0.47) TSHRHSD17B10MEN1KMT2AMMP9
SCHEMBL11774057 0.76 TSHR (0.37) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL12230161 0.75 TSHR (0.48) TSHRHSD17B10MMP9MMP1MMP3
SCHEMBL11774039 0.74 TSHR (0.44) TSHRHSD17B10MEN1KMT2AALDH1A1
SCHEMBL18261812 0.73 MEN1 (0.65) MEN1KMT2AALDH1A1LMNANPSR1
SCHEMBL7872706 0.69 POLB (0.41) TSHRMEN1KMT2ALMNAKDM4E
SCHEMBL29015838 0.69 TSHR (0.42) TSHRHSD17B10MEN1KMT2AMMP9
SCHEMBL27726123 0.67 TSHR (0.52) TSHRHSD17B10MEN1KMT2AALDH1A1

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
US-7655807-B2 Low molecular weight conjugated nitrogen compounds and devices fabricated using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-02-02 US disclosed
US-20080214839-A1 LOW MOLECULAR WEIGHT CONJUGATED NITROGEN COMPOUNDS AND DEVICES FABRICATED USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-09-04 US disclosed
US-7358375-B2 Low molecular weight conjugated nitrogen compounds and devices fabricated using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-04-15 US disclosed
EP-1752458-A2 Low molecular weight conjugated nitrogen compounds and devices obtainable using the same Samsung Electronics Co., Ltd. (KR) 2007-02-14 EP disclosed
US-20070028962-A1 Low molecular weight conjugated nitrogen compounds and devices fabricated using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2007-02-08 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 (2 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-20080214839-A1 LOW MOLECULAR WEIGHT CONJUGATED NITROGEN COMPOUNDS AND DEVICES FABRICATED USING THE SAME NES, ACP1, L1CAM TSHR 4492/4885HSD17B10 4013/4885MEN1 1069/4885
US-20070028962-A1 Low molecular weight conjugated nitrogen compounds and devices fabricated using the same ACP1, NES, L1CAM TSHR 4516/4885HSD17B10 4114/4885MEN1 1659/4885

“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.