SCHEMBL14449092

SCHEMBL14449092

O=C(c1ccccc1)c1cccc(C(=O)c2ccc(-c3cc(-c4ccc(C(=O)c5cccc(C(=O)c6ccccc6)c5)cc4)cc(-c4ccc(C(=O)c5cccc(C(=O)c6ccccc6)c5)cc4)c3)cc2)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.75
TDP1 Q9NUW8 1/20 0.75
L3MBTL1 Q9Y468 1/20 0.75
MEN1 O00255 2/20 0.64
RAB9A P51151 2/20 0.64
KMT2A Q03164 2/20 0.64
LMNA P02545 1/20 0.64
MAPT P10636 1/20 0.64
CA1 P00915 2/20 0.58
CA2 P00918 2/20 0.58
CA9 Q16790 2/20 0.58
ALDH1A1 P00352 1/20 0.58
PBRM1 Q86U86 1/20 0.57
SRD5A2 P31213 1/20 0.56
CA12 O43570 1/20 0.55
CA14 Q9ULX7 1/20 0.55
KMO O15229 1/20 0.53
EGFR P00533 1/20 0.53
NPC1 O15118 1/20 0.52
POLB P06746 1/20 0.50

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
SCHEMBL9402150 0.94 ATM (0.78) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL133482 0.94 RAB9A (0.72) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL28825956 0.88 ATM (0.69) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL135162 0.87 ATM (1.00) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL9324919 0.87 ATM (1.00) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL197633 0.87 RAB9A (0.82) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL13019488 0.87 RAB9A (0.82) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL12551735 0.86 KMO (0.68) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL28870296 0.86 SRD5A2 (0.65) ATMTDP1L3MBTL1MEN1RAB9A
SCHEMBL134239 0.85 MAPT (0.65) ATMTDP1L3MBTL1MEN1RAB9A

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-20070164273-A1 Organic electronic devices MERCK PATENT GMBH (DE) 2007-07-19 US disclosed
US-20070164273-A1 Organic electronic devices MERCK PATENT GMBH (DE) 2007-07-19 US disclosed