SCHEMBL3307301

SCHEMBL3307301

CC(C)(C)OC(=O)N[C@@H]1CN(NC(=O)OCC[Si](C)(C)C)CC[C@@H]1NC(=O)OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PDE4B Q07343 1/20 0.41
MAPT P10636 1/20 0.40
CPB1 P15086 2/20 0.40
CTSL P07711 2/20 0.40
CTSK P43235 2/20 0.40
SYK P43405 1/20 0.40
CTSB P07858 1/20 0.40
RORC P51449 2/20 0.39
KLK7 P49862 1/20 0.39
KLK5 Q9Y337 1/20 0.39
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL206613 0.87 PDE4B (0.48) KMT2AL3MBTL1PDE4BMAPTCPB1
SCHEMBL16667958 0.86 MEN1 (0.47) KMT2AL3MBTL1PDE4BMAPTCTSK
SCHEMBL16667957 0.86 MEN1 (0.47) KMT2AL3MBTL1PDE4BMAPTCTSK
SCHEMBL28683470 0.86 MEN1 (0.47) KMT2AL3MBTL1PDE4BMAPTCTSK
SCHEMBL3308900 0.82 CCR2 (0.49) KMT2AL3MBTL1MAPTCPB1CTSL
SCHEMBL3308896 0.82 CCR2 (0.49) KMT2AL3MBTL1MAPTCPB1CTSL
SCHEMBL207913 0.80 CTSL (0.47) KMT2AL3MBTL1PDE4BCPB1CTSL
SCHEMBL206802 0.78 KMT2A (0.47) KMT2AL3MBTL1PDE4BCPB1CTSL
SCHEMBL208375 0.78 CTSL (0.46) KMT2AL3MBTL1PDE4BCPB1CTSL
SCHEMBL210039 0.78 PDE4B (0.49) KMT2AL3MBTL1PDE4BCPB1CTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100099660-A1 METHOD FOR TREATING THROMBOSIS OR EMBOLISM AND RELATED DISEASES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-04-22 US disclosed
US-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM DAIICHI PHARMACEUTICAL CO., LTD (JP) 2009-11-12 US disclosed
US-7576135-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-08-18 US disclosed
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-11-09 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 (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-20100099660-A1 METHOD FOR TREATING THROMBOSIS OR EMBOLISM AND RELATED DISEASES F2, PLAT, MPL KMT2A 2546/4885L3MBTL1 1698/4885PDE4B 3784/4885
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X F2, C1S, C9 KMT2A 3495/4885L3MBTL1 985/4885PDE4B 4526/4885
US-20090281074-A1 DRUG COMPOSITIONS AND METHODS FOR PREVENTING AND TREATING THROMBOSIS OR EMBOLISM C1R, C9, F2 KMT2A 3693/4885L3MBTL1 1605/4885PDE4B 4357/4885

“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.