SCHEMBL29211148

SCHEMBL29211148

O=C(Nc1ccccc1)c1cc(Cl)ccc1OC(F)(F)F

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 1/20 0.64
GPR27 Q9NS67 1/20 0.64
TMPRSS4 Q9NRS4 3/20 0.63
P2RX1 P51575 5/20 0.60
PNLIP P16233 1/20 0.60
KCNK3 O14649 4/20 0.56
KCNK9 Q9NPC2 4/20 0.56
P2RX4 Q99571 3/20 0.53
P2RX7 Q99572 3/20 0.53
ALDH1A1 P00352 1/20 0.53
SLC2A1 P11166 1/20 0.53
KCNMA1 Q12791 1/20 0.52
LRRK2 Q5S007 2/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
F2R P25116 1/20 0.51
AKR1C3 P42330 1/20 0.51

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
SCHEMBL30211340 0.83 KCNK3 (0.72) AVPR2GPR27PNLIPKCNK3KCNK9
SCHEMBL4753755 0.83 KCNK3 (0.72) AVPR2GPR27PNLIPKCNK3KCNK9
SCHEMBL24438825 0.82 TMPRSS4 (0.64) AVPR2GPR27TMPRSS4P2RX1P2RX4
SCHEMBL17740367 0.82 ALDH1A1 (0.77) AVPR2GPR27TMPRSS4KCNK3KCNK9
SCHEMBL29646468 0.80 ALDH1A1 (0.57) AVPR2GPR27TMPRSS4P2RX1PNLIP
SCHEMBL31743107 0.80 ALPL (0.51) AVPR2GPR27TMPRSS4P2RX1PNLIP
SCHEMBL22980173 0.80 ALDH1A1 (0.57) AVPR2GPR27TMPRSS4P2RX1PNLIP
SCHEMBL2115556 0.79 TSHR (0.53) P2RX1PNLIPALDH1A1
SCHEMBL29646503 0.79 TSHR (0.53) P2RX1PNLIPALDH1A1
SCHEMBL8471311 0.79 STK39 (0.49) AVPR2GPR27TMPRSS4P2RX1PNLIP

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
CN-118042960-A Filaments for oral care implements 联合利华知识产权控股有限公司 2024-05-14 CN disclosed