SCHEMBL2188134

SCHEMBL2188134

O=C(c1ccccc1)c1ccc2c(c1)C(=C1c3cc(C(=O)c4ccccc4)ccc3-c3ccc(C(=O)c4ccccc4)cc31)c1cc(C(=O)c3ccccc3)ccc1-2

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.61
ATM Q13315 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
ALDH1A1 P00352 2/20 0.58
SRD5A2 P31213 1/20 0.56
CYP2C8 P10632 1/20 0.53
CYP2C9 P11712 1/20 0.53
PTPRC P08575 3/20 0.53
PBRM1 Q86U86 1/20 0.52
RAB9A P51151 4/20 0.52
NPC1 O15118 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HPGD P15428 3/20 0.50
CNR2 P34972 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
PDK2 Q15119 1/20 0.49
LMNA P02545 2/20 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
SCHEMBL13849150 0.86 TTR (0.63) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL17196578 0.82 PTPRC (0.61) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL11814593 0.82 PTPRC (0.61) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL6421185 0.82 ATM (0.59) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL27560697 0.80 TTR (0.72) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL314267 0.79 ALDH1A1 (0.93) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL9066312 0.79 ALDH1A1 (0.93) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL1271059 0.79 TDP1 (0.55) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL11422252 0.77 ATM (0.53) L3MBTL1ATMTDP1ALDH1A1SRD5A2
SCHEMBL9324919 0.77 ATM (1.00) L3MBTL1ATMTDP1ALDH1A1SRD5A2

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-2342172-B1 BIFLUORENYLIDENE DERIVATIVES, THEIR PREPARATION AND USES THEREOF UNIV ROMA (IT) 2012-08-08 EP disclosed
EP-2342172-B1 BIFLUORENYLIDENE DERIVATIVES, THEIR PREPARATION AND USES THEREOF UNIV ROMA (IT) 2012-08-08 EP disclosed
EP-2342172-A1 BIFLUORENYLIDENE DERIVATIVES, THEIR PREPARATION AND USES THEREOF Università degli Studi di Roma "La Sapienza" (IT) 2011-07-13 EP disclosed
WO-2010038251-A1 BIFLUORENYLIDENE DERIVATIVES, THEIR PREPARATION AND USES THEREOF UNIVERSITÀ DEGLI STUDI DI ROMA LA SAPIENZA (IT) 2010-04-08 WO disclosed
WO-2010038251-A1 BIFLUORENYLIDENE DERIVATIVES, THEIR PREPARATION AND USES THEREOF UNIVERSITÀ DEGLI STUDI DI ROMA LA SAPIENZA (IT) 2010-04-08 WO disclosed