SCHEMBL6599562

SCHEMBL6599562

Cc1ncn(CCCOCc2ccccc2)c1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DUT P33316 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 5/20 0.34
TEAD3 Q99594 1/20 0.33
LMNA P02545 2/20 0.33
TP53 P04637 2/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTT P42858 1/20 0.32
HRH4 Q9H3N8 1/20 0.32

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
SCHEMBL6598217 0.85 TDP1 (0.37) DUTMEN1KMT2ALMNATP53
SCHEMBL6599980 0.85 DUT (0.38) DUTMAPTCYP1A2CYP2C19SMN1; SMN2
SCHEMBL6599697 0.81 ATP4A (0.42) MEN1KMT2AL3MBTL1TEAD3LMNA
SCHEMBL6599808 0.81 MEN1 (0.40) MEN1KMT2AL3MBTL1TEAD3LMNA
SCHEMBL29960517 0.75 TSHR (0.44) DUTMEN1KMT2AL3MBTL1TDP1
SCHEMBL29132544 0.73 L3MBTL1 (0.41) DUTMEN1KMT2AL3MBTL1TDP1
SCHEMBL30378547 0.73 L3MBTL1 (0.41) DUTMEN1KMT2AL3MBTL1TDP1
SCHEMBL6598862 0.72 MEN1 (0.36) DUTMEN1KMT2AL3MBTL1TEAD3
SCHEMBL2830035 0.72 DUT (0.39) DUT
SCHEMBL1743547 0.72 L3MBTL1 (0.47) DUTMEN1KMT2AL3MBTL1TDP1

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
EP-1169320-B1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2004-09-22 EP disclosed
US-6511978-B1 For treating cancer, restenosis, atherosclerosis or viral infections LG LIFE SCIENCES, LTD. (KR) 2003-01-28 US disclosed
EP-1169320-A4 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2002-10-30 EP disclosed
EP-1169320-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG Chem Investment, Ltd. (KR) 2002-01-09 EP disclosed
WO-2000064891-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD. (KR) 2000-11-02 WO disclosed