SCHEMBL7982383

SCHEMBL7982383

CCn1c(-c2ccc(N)cc2C(F)(F)F)nnc1C(C)(C)Oc1c(F)cc(F)cc1F

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.37
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
HSD11B1 P28845 4/20 0.33

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
SCHEMBL7982385 0.90 KIT (0.31)
SCHEMBL7985365 0.88 RORC (0.38) GLAPOLBGAATSHRHSD11B1
SCHEMBL7978754 0.87 HSD11B1 (0.35) HSD11B1
SCHEMBL7968601 0.86 ACSS2 (0.37)
SCHEMBL1418638 0.85 NSD2 (0.33)
SCHEMBL7984625 0.83 KDM4E (0.36)
SCHEMBL7980163 0.83 P2RX7 (0.36)
SCHEMBL7978690 0.82 HSD11B1 (0.36) HSD11B1
SCHEMBL12671069 0.78 HSD11B1 (0.47) HSD11B1
SCHEMBL7988318 0.78 RORC (0.40)

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-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO disclosed