SCHEMBL24910219

SCHEMBL24910219

CC(C)c1cnc(C(F)(F)F)cc1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
TSHR P16473 1/20 0.37
CRHBP P24387 1/20 0.37
CYP2C19 P33261 1/20 0.37
CRHR2 Q13324 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36
CA2 P00918 1/20 0.35
CHKA P35790 1/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
P2RX3 P56373 1/20 0.33
P2RX2 Q9UBL9 1/20 0.33
TRPV3 Q8NET8 7/20 0.33
TRPA1 O75762 1/20 0.33
RPS6KA3 P51812 1/20 0.33
LOXL2 Q9Y4K0 2/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
FEN1 P39748 1/20 0.31

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
SCHEMBL25165502 0.86 SCN10A (0.37) PDE2ACYP3A4CYP2D6TSHRCRHBP
SCHEMBL23502436 0.84 P2RX3 (0.33) PDE2AP2RX3P2RX2RPS6KA3FEN1
SCHEMBL23970861 0.83 CYP3A4 (0.39) CYP3A4CYP2D6TSHRCRHBPCYP2C19
SCHEMBL13086672 0.82 PDE2A (0.42) PDE2ACYP3A4CYP2D6TSHRCRHBP
SCHEMBL19105584 0.80 NOTUM (0.37) CYP3A4CYP2D6TSHRCRHBPCYP2C19
SCHEMBL16248180 0.80 HSP90AA1 (0.40) CYP3A4CYP2D6TSHRCRHBPCYP2C19
SCHEMBL19105630 0.80 CYP3A4 (0.37) CYP3A4CYP2D6TSHRCRHBPCYP2C19
SCHEMBL24850231 0.78 USP1 (0.37) CYP3A4CYP2D6TSHRCRHBPCYP2C19
SCHEMBL21625521 0.77 CA2 (0.41) CYP3A4CYP2D6TSHRCRHBPCYP2C19
SCHEMBL12263473 0.77 PDE2A (0.35) PDE2ACYP3A4CYP2D6TSHRCRHBP

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-4122934-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-01-25 EP disclosed