SCHEMBL7897756

SCHEMBL7897756

C[SiH](C)Oc1ccccc1C(C)(C)CCO

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
GAA P10253 1/20 0.31
NR1I2 O75469 1/20 0.30
HSD11B1 P28845 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL29138553 0.81 CA1 (0.43) KDM4EALDH1A1GAA
SCHEMBL8173016 0.76 RXRA (0.42) KDM4EALDH1A1RXRARXRBRXRG
SCHEMBL18114066 0.75 KDM4E (0.35) KDM4EALDH1A1RXRARXRBRXRG
SCHEMBL18114021 0.75 PTGS2 (0.45) KDM4EALDH1A1
SCHEMBL18114067 0.74 INPPL1 (0.43) KDM4EALDH1A1
SCHEMBL12680655 0.72 ALDH1A1 (0.46) KDM4EALDH1A1RXRARXRBRXRG
SCHEMBL18121309 0.71 ALDH1A1 (0.56) KDM4EALDH1A1NR1I2HSD11B1MAPT
SCHEMBL7897761 0.70 CA2 (0.38) KDM4EALDH1A1RXRARXRBRXRG
SCHEMBL18121465 0.70 NPSR1 (0.36) ALDH1A1RXRARXRBRXRGGAA
SCHEMBL18114042 0.70 L3MBTL1 (0.48) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204293-B1 INHIBITING POST-TRANSLATIONAL MODIFICATION OF THE ONCOGENIC RAS PROTEIN BY PROTEIN FARNESYLTRANSFERASE, PROTEIN GERANYLGERANYLTRANSFERASE, OR BOTH UNIVERSITY OF PITTSBURGH 2001-03-20 US disclosed
WO-1998050031-A1 INHIBITORS OF PROTEIN ISOPRENYL TRANSFERASES UNIVERSITY OF PITTSBURGH (US) 1998-11-12 WO disclosed