SCHEMBL4356471

SCHEMBL4356471

CN(C)C(=S)[C@H]1CCCC(N(NC(=O)C(=O)Nc2ccc(Cl)cn2)C(=O)OC(C)(C)C)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
RAB9A P51151 4/20 0.38
NPC1 O15118 2/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
USP30 Q70CQ3 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
PTK2 Q05397 1/20 0.35
F10 P00742 3/20 0.34
F2 P00734 1/20 0.34
F5 P12259 1/20 0.34
MAPT P10636 2/20 0.34
IDO1 P14902 2/20 0.34
TDO2 P48775 1/20 0.34

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
SCHEMBL368516 0.91 L3MBTL1 (0.43) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL715127 0.91 L3MBTL1 (0.43) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL4268700 0.90 L3MBTL1 (0.41) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL4955372 0.89 L3MBTL1 (0.44) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL4267279 0.88 L3MBTL1 (0.43) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL4260523 0.87 L3MBTL1 (0.41) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL3309223 0.84 L3MBTL1 (0.41) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL3306854 0.83 USP30 (0.41) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL3307770 0.81 L3MBTL1 (0.38) L3MBTL1RAB9ANPC1ALDH1A1NPSR1
SCHEMBL3306039 0.81 L3MBTL1 (0.38) L3MBTL1RAB9ANPC1ALDH1A1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM DAIICHI PHARMACEUTICAL CO., LTD (JP) 2009-11-12 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-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM C1R, C9, F2 L3MBTL1 1605/4885RAB9A 1678/4885NPC1 3934/4885

“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.