SCHEMBL7910068

SCHEMBL7910068

O=C(OCC1CCCCC1)c1cccc(OCC2CCCCC2)c1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 1/20 0.53
PARP10 Q53GL7 4/20 0.52
PARP15 Q460N3 3/20 0.52
NR1H4 Q96RI1 1/20 0.51
SIRT2 Q8IXJ6 1/20 0.50
TLR4 O00206 1/20 0.49
TLR2 O60603 1/20 0.49
JMJD6 Q6NYC1 1/20 0.48
HPGD P15428 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL931179 0.91 HPGD (0.54) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL931524 0.89 HPGD (0.52) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL10293632 0.88 KAT6A (0.54) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL20897525 0.86 NR1H4 (0.54) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL30575482 0.86 NR1H4 (0.67) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL12420676 0.86 NR1H4 (0.67) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL12420668 0.86 NR1H4 (0.67) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL932137 0.86 NR1H4 (0.67) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL7439527 0.84 PARP10 (0.69) KAT6APARP10PARP15NR1H4SIRT2
SCHEMBL2208211 0.84 NR1H4 (0.55) KAT6APARP10PARP15NR1H4HPGD

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