SCHEMBL21292015

SCHEMBL21292015

CCCCNC(=S)Nc1c(C)cccc1C

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.56
HTT P42858 6/20 0.56
ALDH1A1 P00352 5/20 0.56
GAA P10253 3/20 0.56
MAPT P10636 2/20 0.56
MAPK1 P28482 2/20 0.56
PKM P14618 1/20 0.56
RECQL P46063 1/20 0.56
SMN1; SMN2 Q16637 6/20 0.55
POLB P06746 1/20 0.54
ATM Q13315 1/20 0.54
HPGD P15428 2/20 0.54
KMT2A Q03164 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MEN1 O00255 1/20 0.50
ALOX12 P18054 1/20 0.50

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
SCHEMBL20026965 0.91 ALDH1A1 (0.60) LMNAHTTALDH1A1GAAMAPT
SCHEMBL19420682 0.90 ALDH1A1 (0.58) LMNAHTTALDH1A1GAAMAPT
SCHEMBL9800938 0.86 EPHX2 (0.51) LMNAHTTALDH1A1GAAMAPT
SCHEMBL9800937 0.86 EPHX2 (0.51) LMNAHTTALDH1A1GAAMAPT
SCHEMBL23505645 0.84 ALDH1A1 (0.53) LMNAHTTALDH1A1GAAMAPT
SCHEMBL11757878 0.83 KMT2A (0.69) LMNAHTTALDH1A1GAAMAPT
SCHEMBL6097794 0.82 POLB (0.60) LMNAHTTALDH1A1GAAMAPT
SCHEMBL22454914 0.81 ALDH1A1 (0.54) LMNAHTTALDH1A1GAAMAPT
SCHEMBL19420698 0.81 ALDH1A1 (0.51) LMNAHTTALDH1A1GAAMAPT
SCHEMBL11133485 0.81 LMNA (0.45) LMNAHTTALDH1A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109843949-B Thioguanidine group IV transition metal catalysts and polymerization systems 陶氏环球技术有限责任公司 2021-08-10 CN disclosed
EP-3519463-B1 THIOGUANIDINE GROUP IV TRANSITION METAL CATALYSTS AND POLYMERIZATION SYSTEMS DOW GLOBAL TECHNOLOGIES LLC (US) 2020-12-23 EP disclosed
US-10647799-B2 Thioguanidine group IV transition metal catalysts and polymerization systems DOW GLOBAL TECHNOLOGIES LLC (US) 2020-05-12 US disclosed
US-10647799-B2 Thioguanidine group IV transition metal catalysts and polymerization systems DOW GLOBAL TECHNOLOGIES LLC (US) 2020-05-12 US disclosed
US-20190263949-A1 THIOGUANIDINE GROUP IV TRANSITION METAL CATALYSTS AND POLYMERIZATION SYSTEMS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-08-29 US disclosed
US-20190263949-A1 THIOGUANIDINE GROUP IV TRANSITION METAL CATALYSTS AND POLYMERIZATION SYSTEMS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-08-29 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-10647799-B2 Thioguanidine group IV transition metal catalysts and polymerization systems HBG2, QSOX1, HBG1 LMNA 4615/4885HTT 717/4885ALDH1A1 1200/4885
US-20190263949-A1 THIOGUANIDINE GROUP IV TRANSITION METAL CATALYSTS AND POLYMERIZATION SYSTEMS HBG2, QSOX1, HBG1 LMNA 4615/4885HTT 717/4885ALDH1A1 1200/4885

“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.