SCHEMBL7093905

SCHEMBL7093905

NC(=O)C(c1ccccc1)N(c1ccccc1)c1ccc(Br)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
TRPM8 Q7Z2W7 7/20 0.44
S1PR3 Q99500 1/20 0.41
HTR2A P28223 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
ALOX5 P09917 2/20 0.39
NR1I2 O75469 1/20 0.38
FPR2 P25090 1/20 0.38
CNR1 P21554 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7093909 0.89 TRPM8 (0.51) EPHX1TRPM8LMNAALOX5NR1I2
SCHEMBL7092758 0.86 TRPM8 (0.41) EPHX1MEN1KMT2ATRPM8ALDH1A1
SCHEMBL7090261 0.85 KDM4E (0.47) EPHX1TRPM8ALDH1A1ALOX5NR1I2
SCHEMBL7093895 0.84 IDO1 (0.44) EPHX1MEN1KMT2ATRPM8ALDH1A1
SCHEMBL7094118 0.78 TRPM8 (0.43) TRPM8NR1I2
SCHEMBL7093888 0.75 CPN1 (0.46) EPHX1TRPM8ALOX5NR1I2
SCHEMBL7094981 0.75 NR3C2 (0.56) KMT2ATRPM8ALDH1A1LMNASMN1; SMN2
SCHEMBL28275848 0.74 SRC (0.50) TRPM8LMNAALOX5
SCHEMBL7758852 0.73 MEN1 (0.77) EPHX1MEN1KMT2AS1PR3HTR2A
SCHEMBL4566801 0.71 TRPM8 (0.53) EPHX1TRPM8ALDH1A1LMNAALOX5

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
WO-2003082777-A2 NOVEL GLUCOCORTICOID RECEPTOR LIGANDS KARO BIO AB (SE) 2003-10-09 WO claimed
WO-2003082777-A2 NOVEL GLUCOCORTICOID RECEPTOR LIGANDS KARO BIO AB (SE) 2003-10-09 WO disclosed