SCHEMBL1828996

SCHEMBL1828996

O=C(O)c1c[nH]c(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 1/20 0.39
ACMSD Q8TDX5 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MGAM O43451 1/20 0.37
LMNA P02545 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
P4HTM Q9NXG6 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
HPGD P15428 1/20 0.36
MAPT P10636 2/20 0.33
KMO O15229 2/20 0.33
CYP1A2 P05177 1/20 0.33
BRD4 O60885 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33

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
SCHEMBL6821893 0.87 ALDH1A1 (0.37) KDM4EALDH1A1HSD17B10MAPTCYP1A2
SCHEMBL1830315 0.83 KCNN4 (0.40) KDM4ETSHRLMNAALDH1A1HSD17B10
SCHEMBL7406367 0.82 MAPT (0.33) ALDH1A1MAPTKMT2A
SCHEMBL10896790 0.81 L3MBTL1 (0.39) KDM4ELMNAL3MBTL1HPGDMAPT
SCHEMBL7405033 0.78 KCNN4 (0.36) TDP1KMT2A
SCHEMBL18065068 0.78 TRPM8 (0.36)
SCHEMBL8370808 0.77 LCK (0.38) HPGDKMT2A
SCHEMBL6821626 0.77 RECQL (0.50) TDP1LMNAALDH1A1HPGDMAPT
SCHEMBL7974226 0.76 KDM4E (0.44) KDM4ETSHRLMNAL3MBTL1ALDH1A1
SCHEMBL7842985 0.76 AKR1B1 (0.36) KDM4ETSHRTDP1LMNAL3MBTL1

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-2318375-A1 IMIDAZOLE CARBOXAMIDES ELI LILLY AND COMPANY (US) 2011-05-11 EP disclosed
WO-2010009062-A1 IMIDAZOLE CARBOXAMIDES ELI LILLY AND COMPANY (US) 2010-01-21 WO disclosed