SCHEMBL5093089

SCHEMBL5093089

CC[Si](CC)(CC)c1nccn1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LPO P22079 1/20 0.43
HTT P42858 1/20 0.39
KMT2A Q03164 4/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 2/20 0.35
TLR8 Q9NR97 2/20 0.33
FDPS P14324 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 2/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL6345915 0.73 LPO (0.48) LPOHTTKMT2AALDH1A1POLB
SCHEMBL27792290 0.72 LPO (0.39) LPOHTTKMT2AALDH1A1POLB
SCHEMBL6829172 0.71 LPO (0.46) LPOHTTKMT2AALDH1A1FDPS
SCHEMBL8089847 0.71 LPO (0.41) LPOHTTKMT2AALDH1A1FDPS
Hydrochloric Acid SCHEMBL28481823 0.71 LPO (0.38) LPOHTTKMT2AALDH1A1POLB
SCHEMBL8076706 0.70 LPO (0.36) LPOHTTKMT2AALDH1A1POLB
SCHEMBL7569341 0.69 ALDH1A1 (0.33) KMT2AALDH1A1POLBTLR8
SCHEMBL8076693 0.68 LPO (0.43) LPOHTTKMT2AALDH1A1FDPS
SCHEMBL27769632 0.68 LPO (0.43) LPOHTTKMT2APOLBFDPS
SCHEMBL8076701 0.67 LPO (0.38) LPOHTTFDPSL3MBTL1CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524961-B2 Diastereoselective addition of lithiated N-methylimidazole on sulfinimines JANSSEN PHARMACEUTICA, N.V. (BE) 2009-04-28 US disclosed
US-7323570-B2 Farnesyltransferase inhibitors ABBOTT LABORATORIES (US) 2008-01-29 US disclosed
US-20070293679-A1 Diastereoselective Addition of Lithiated N-Methylimidazole on Sulfinimines JANSSEN PHARMACEUTICA N.V. (BE) 2007-12-20 US disclosed
US-7211595-B2 Farnesyltransferase inhibitors ABBOTT LABORATORIES (US) 2007-05-01 US disclosed
US-20060264476-A1 Farnesyltransferase Inhibitors ABBVIE INC. 2006-11-23 US disclosed
EP-1339695-B1 FARNESYLTRANSFERASE INHIBITORS ABBOTT LAB (US) 2006-04-19 EP disclosed
CN-1487924-A Farnesyl transferase inhibitors ���Ͽع����޹�˾ 2004-04-07 CN disclosed
EP-1339695-A1 FARNESYLTRANSFERASE INHIBITORS Abbott Laboratories (US) 2003-09-03 EP disclosed
US-20030087940-A1 Farnesyltransferase inhibitors ABBVIE INC. 2003-05-08 US disclosed
EP-1276726-A2 SUBSTITUTED PHENYL FARNESYLTRANSFERASE INHIBITORS Abbott Laboratories (US) 2003-01-22 EP disclosed
WO-2002074747-A1 FARNESYLTRANSFERASE INHIBITORS ABBOTT LABORATORIES (US) 2002-09-26 WO disclosed
US-20020115640-A1 Such as 4-(((6-chloro-2-(3-chlorophenyl)-3-pyridinyl) methoxy)(1-methyl-1H-imidazol-5-yl)methyl)benzonitrile; anticancer agents ABBOTT LABORATORIES 2002-08-22 US disclosed
US-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors ABBOTT LABORATORIES 2002-02-14 US disclosed
WO-2001081316-A2 SUBSTITUTED PHENYL FARNESYLTRANSFERASE INHIBITORS ABBOTT LABORATORIES (US) 2001-11-01 WO 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 (5 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-20020115640-A1 Such as 4-(((6-chloro-2-(3-chlorophenyl)-3-pyridinyl) methoxy)(1-methyl-1H-imidazol-5-yl)methyl)benzonitrile; anticancer agents FNTB, FNTA, ACAT2 LPO 4417/4885HTT 4676/4885KMT2A 1830/4885
US-20060264476-A1 Farnesyltransferase Inhibitors FNTB, FNTA, FDPS LPO 4193/4885HTT 4628/4885KMT2A 2346/4885
US-20030087940-A1 Farnesyltransferase inhibitors FNTB, FNTA, FDPS LPO 4400/4885HTT 4733/4885KMT2A 2634/4885
US-20020019527-A1 Substituted phenyl farnesyltransferase inhibitors FNTA, FNTB, SLC10A1 LPO 4151/4885HTT 4007/4885KMT2A 3687/4885
US-20070293679-A1 Diastereoselective Addition of Lithiated N-Methylimidazole on Sulfinimines SULT1A1, SULT1E1, CSNK1A1L LPO 3929/4885HTT 4648/4885KMT2A 145/4885

“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.