SCHEMBL6863006

SCHEMBL6863006

O=C1CC(c2ccccc2)c2cc(C(O)c3ccc(Cl)cc3)ccc2N1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.50
LMNA P02545 1/20 0.46
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
ATM Q13315 1/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
SIRT2 Q8IXJ6 1/20 0.41
GPBAR1 Q8TDU6 1/20 0.40
HSD17B2 P37059 1/20 0.39
GAA P10253 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL7701639 0.80 TP53 (0.51) TP53LMNAMAPTATMKMT2A
SCHEMBL880275 0.78 TP53 (0.57) TP53LMNAMAPTSMN1; SMN2ATM
SCHEMBL6872269 0.78 TBXAS1 (0.56) TP53MAPTKMT2AMEN1ALDH1A1
SCHEMBL880444 0.76 TP53 (0.59) TP53LMNAMAPTSMN1; SMN2KMT2A
SCHEMBL5561611 0.74 HTT (0.46) TP53LMNAMAPTATMKMT2A
SCHEMBL12559670 0.73 TDP1 (0.57) TP53LMNASMN1; SMN2ATMKMT2A
SCHEMBL14094474 0.73 SIRT2 (0.66) TP53LMNAMAPTKMT2AMEN1
SCHEMBL880376 0.72 ALDH1A1 (0.58) TP53LMNAMAPTSMN1; SMN2KMT2A
SCHEMBL7156373 0.72 ALDH1A1 (0.58) TP53LMNAMAPTSMN1; SMN2KMT2A
SCHEMBL12698414 0.72 ALDH1A1 (0.58) TP53LMNAMAPTSMN1; SMN2KMT2A

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
EP-1106610-B1 Farnesyl transferase inhibiting 2-quinolone derivatives JANSSEN PHARMACEUTICA NV (BE) 2004-06-16 EP disclosed
EP-1019395-B1 FARNESYL TRANSFERASE INHIBITING 2-QUINOLONE DERIVATIVES JANSSEN PHARMACEUTICA NV (BE) 2002-01-30 EP disclosed
EP-1106610-A1 Farnesyl transferase inhibiting 2-quinolone derivatives Janssen Pharmaceutica N.V. (BE) 2001-06-13 EP disclosed
US-5968952-A ANTITUMOR AGENTS JANSSEN PHARMACEUTICA, N.V. (BE) 1999-10-19 US disclosed