SCHEMBL479574

SCHEMBL479574

COC(=O)c1ccc2c(c1)NC(=O)C2=C(Nc1cc(Cl)c(C(C)(C)N)c(Cl)c1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
TP53 P04637 1/20 0.42
THRB P10828 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RAB9A P51151 5/20 0.37
KMT2A Q03164 4/20 0.37
NPC1 O15118 4/20 0.37
MEN1 O00255 3/20 0.37
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.36
ALOX5 P09917 1/20 0.35

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
SCHEMBL479313 0.91 RXFP1 (0.43) TP53THRBTDP1RAB9AKMT2A
SCHEMBL479436 0.89 MAPT (0.40) POLBTP53THRBBLMTDP1
SCHEMBL2568537 0.88 KMT2A (0.43) POLBTP53THRBBLMTDP1
SCHEMBL27588868 0.86 POLB (0.40) POLBTP53THRBBLMTDP1
SCHEMBL2120036 0.85 RAB9A (0.46) POLBTP53THRBBLMTDP1
SCHEMBL479876 0.85 RAB9A (0.46) POLBTP53THRBBLMTDP1
SCHEMBL2123765 0.84 RAB9A (0.49) POLBTP53THRBBLMTDP1
SCHEMBL2123767 0.84 RAB9A (0.49) POLBTP53THRBBLMTDP1
SCHEMBL479572 0.84 TP53 (0.39) POLBTP53THRBBLMTDP1
SCHEMBL479573 0.84 TP53 (0.39) POLBTP53THRBBLMTDP1

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
EP-2411034-A1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS Life & Brain GmbH (DE) 2012-02-01 EP disclosed
WO-2010108665-A1 PROMOTION OF NEURONAL INTEGRATION IN NEURAL STEM CELL GRAFTS LIFE & BRAIN GMBH (DE) 2010-09-30 WO disclosed