SCHEMBL17156325

SCHEMBL17156325

CCOc1n[nH]c(C)c1Oc1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 5/20 0.44
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
MAPT P10636 4/20 0.44
TP53 P04637 2/20 0.44
ALOX12 P18054 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
ALDH1A1 P00352 2/20 0.41
ESR1 P03372 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 2/20 0.41
HTT P42858 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL17156161 0.83 DHODH (0.50) L3MBTL1LMNAMEN1KMT2AMAPT
SCHEMBL17156291 0.83 MAPT (0.44) L3MBTL1LMNAMEN1KMT2AMAPT
SCHEMBL17156142 0.83 MRGPRX1 (0.42) LMNAMEN1KMT2AMAPTTP53
SCHEMBL17156216 0.81 TTR (0.42) TTRLMNAMEN1KMT2AMAPT
SCHEMBL3260000 0.80 KMT2A (0.48) LMNAMEN1KMT2AMAPTTP53
SCHEMBL17156183 0.78 CCR4 (0.41) TTRL3MBTL1LMNAMEN1KMT2A
SCHEMBL17156374 0.77 TTR (0.46) TTRLMNAMEN1KMT2AMAPT
SCHEMBL17156249 0.73 LPAR2 (0.41) LMNAMEN1KMT2AMAPTTP53
SCHEMBL17156158 0.71 MAPT (0.46) L3MBTL1LMNAMEN1KMT2AMAPT
SCHEMBL3392191 0.71 MEN1 (0.45) LMNAMEN1KMT2AMAPTTP53

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2929883-A1 Pyrazole derivatives as dihydroorotate dehydrogenase (DHODH) inhibitors INSTITUT PASTEUR (FR) 2015-10-14 EP disclosed