SCHEMBL7977548

SCHEMBL7977548

C[C@H](Oc1ncc(N)cc1Cl)c1nnc(-c2ccccc2Cl)n1C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 13/20 0.47
RORC P51449 1/20 0.39
LMNA P02545 2/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL7984122 0.91 HSD11B1 (0.47) HSD11B1LMNANPC1ALDH1A1RAB9A
SCHEMBL7987984 0.88 HSD11B1 (0.50) HSD11B1
SCHEMBL7967520 0.85 HSD11B1 (0.42) HSD11B1RORCLMNAMAPTTSHR
SCHEMBL12671009 0.84 HSD11B1 (0.44) HSD11B1RORC
SCHEMBL7977555 0.82 HSD11B1 (0.49) HSD11B1LMNANPC1ALDH1A1RAB9A
SCHEMBL7988091 0.78 HSD11B1 (0.43) HSD11B1RORCLMNAMAPTTSHR
SCHEMBL12671016 0.78 HSD11B1 (0.45) HSD11B1
SCHEMBL7977558 0.77 HSD11B1 (0.49) HSD11B1LMNANPC1ALDH1A1RAB9A
SCHEMBL7985076 0.76 HSD11B1 (0.51) HSD11B1RAB9ASMN1; SMN2
SCHEMBL7982228 0.76 HSD11B1 (0.51) HSD11B1RAB9ASMN1; SMN2

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