SCHEMBL26097041

SCHEMBL26097041

Cc1nnc(-c2ccc(CNC(=O)O)c(C(F)(F)F)c2)nn1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 15/20 0.46
PPARG P37231 7/20 0.43
BTK Q06187 1/20 0.42
P2RX7 Q99572 3/20 0.42

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
SCHEMBL26101623 0.90 NTRK1 (0.44) EPHX2PPARGP2RX7
SCHEMBL26101477 0.86 CACNA1H (0.45) EPHX2PPARGBTK
SCHEMBL26102152 0.78 NOTUM (0.35)
SCHEMBL30392478 0.76 CACNA1H (0.45) EPHX2
SCHEMBL26099209 0.76 CACNA1H (0.45) EPHX2
SCHEMBL4678727 0.75 EPHX2 (0.48) EPHX2PPARGP2RX7
SCHEMBL1884357 0.74 EPHX2 (0.47) EPHX2PPARGP2RX7
SCHEMBL16822059 0.71 EPHX2 (0.41) EPHX2P2RX7
SCHEMBL26099823 0.70 EPHX2 (0.51) EPHX2P2RX7
SCHEMBL22659485 0.70 GSK3B (0.51)

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
WO-2023077129-A1 TETRAZINE CONJUGATES FOR IN VIVO TARGETED DELIVERY OF A PAYLOAD TAMBO, INC. (US) 2023-05-04 WO disclosed