SCHEMBL28334523

SCHEMBL28334523

O=CNc1cccc2c3c([nH]c12)CC=CC3

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PABPC1 P11940 1/20 0.36
▸ PARP14 Q460N5 1/20 0.34
▸ GFER P55789 1/20 0.32
▸ MAPT P10636 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TSHR P16473 1/20 0.30
▸ NISCH Q9Y2I1 1/20 0.30

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
SCHEMBL28336845 0.79 GFER (0.54) PABPC1PARP14GFERMAPTALOX15
SCHEMBL27648564 0.71 JAK2 (0.53) PABPC1PARP14MAPTHSD17B10
SCHEMBL28905717 0.70 PARP1 (0.54) PABPC1CASP7HSD17B10TSHR
SCHEMBL28334447 0.69 BTK (0.47) —
SCHEMBL28164562 0.69 AHR (0.53) PABPC1PARP14MAPTMAPK1TSHR
SCHEMBL29506423 0.67 PABPC1 (0.59) PABPC1MAPTALOX15HSD17B10TSHR
SCHEMBL15453221 0.67 PABPC1 (0.59) PABPC1MAPTALOX15HSD17B10TSHR
SCHEMBL28188584 0.67 POLB (0.55) PABPC1PARP14MAPT
SCHEMBL28166021 0.66 JAK2 (0.38) PABPC1PARP14MAPT
SCHEMBL28164437 0.63 NR3C1 (0.56) PABPC1MAPTMAPK1TSHR

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-110312713-A Process for preparing tetrahydrocarbazole carboxamide compounds 百时美施贵宝公司 2019-10-08 — — CN disclosed
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