SCHEMBL8414880

SCHEMBL8414880

O=C(Oc1c(F)c(F)c(F)c(F)c1F)c1cc2ccccc2cn1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2A6 P11509 1/20 0.40
GABRA1 P14867 2/20 0.39
GABRG2 P18507 2/20 0.39
GABRB3 P28472 2/20 0.39
GABRA5 P31644 2/20 0.39
GABRA3 P34903 2/20 0.39
GABRA2 P47869 2/20 0.39
GABRA4 P48169 2/20 0.39
GABRA6 Q16445 2/20 0.39
MTOR P42345 1/20 0.39
LCK P06239 1/20 0.38
NPC1 O15118 1/20 0.37
TRPM8 Q7Z2W7 3/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 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
SCHEMBL117175 0.81 GABRA1 (0.46) EGLN1KMT2AGABRA1GABRG2GABRB3
SCHEMBL9318876 0.80 EGLN1 (0.47) EGLN1CYP1A2CYP2A6GABRA1GABRG2
SCHEMBL29840564 0.79 LCK (0.56) EGLN1CYP1A2CYP2A6GABRA1GABRG2
SCHEMBL214090 0.79 LCK (0.56) EGLN1CYP1A2CYP2A6GABRA1GABRG2
SCHEMBL5889663 0.78 TDP1 (0.41) MEN1KMT2ATDP1NPC1ALDH1A1
Hydrochloric Acid SCHEMBL27800514 0.78 LCK (0.55) EGLN1CYP1A2CYP2A6GABRA1GABRG2
SCHEMBL5805411 0.77 MAPT (0.57) MEN1KMT2ATDP1GABRA1GABRG2
SCHEMBL27950633 0.76 EGLN1 (0.43) EGLN1CYP1A2CYP2A6GABRA1GABRG2
SCHEMBL7025748 0.75 GABRG2 (0.57) EGLN1CYP1A2CYP2A6GABRA1GABRG2
SCHEMBL3834448 0.75 KDM4E (0.48) EGLN1MEN1KMT2ACYP1A2GABRA1

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
US-5972927-A ANTIINFLAMMATORY, ANTIALLERGIC AND BRONCHODILATORY MEDICINAL PRODUCTS, TREATMENT OF ASTHMA JOUVEINAL (FR) 1999-10-26 US disclosed