SCHEMBL2854467

SCHEMBL2854467

O=C(NCCc1ccc(F)cc1)Oc1cnn(-c2cccc(Cl)n2)c1C(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
P2RX7 Q99572 1/20 0.36
TAAR1 Q96RJ0 1/20 0.36
SPR P35270 1/20 0.36
CES2 O00748 1/20 0.36
CNR1 P21554 1/20 0.35
TP53 P04637 2/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
TRPV1 Q8NER1 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK14 Q16539 1/20 0.34
PTGER4 P35408 1/20 0.34
PLAAT3 P53816 1/20 0.34
PLAAT5 Q96KN8 1/20 0.34
PLAAT2 Q9NWW9 1/20 0.34
PLAAT4 Q9UL19 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL2859504 0.94 TAAR1 (0.43) MAPTTAAR1CNR1LMNATRPV1
SCHEMBL2850252 0.87 TRPV1 (0.40) P2RX7CNR1LMNAGAATRPV1
SCHEMBL2857979 0.86 TRPV1 (0.39) TAAR1CNR1TRPV1KDM4E
SCHEMBL2850556 0.86 KDM4E (0.41) MAPTCES2CNR1LMNAGAA
SCHEMBL2863154 0.84 MAPT (0.45) MAPTP2RX7SPRTP53LMNA
SCHEMBL2850857 0.84 TP53 (0.46) MAPTP2RX7TAAR1CNR1TP53
SCHEMBL2860458 0.84 TP53 (0.46) MAPTP2RX7TAAR1CNR1TP53
SCHEMBL2856562 0.84 MAPT (0.48) MAPTP2RX7TAAR1TP53LMNA
SCHEMBL2853347 0.83 TRPV1 (0.41) MAPTTRPV1ALDH1A1MAPK14PTGER4
SCHEMBL2859714 0.83 KDM4E (0.42) MAPTSPRCES2CNR1LMNA

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-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed