SCHEMBL30633585

SCHEMBL30633585

Cc1cc(Br)ccc1-c1ncn(C)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHR1 P34998 1/20 0.36
▸ TYK2 P29597 6/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ APOBEC3G Q9HC16 1/20 0.34
▸ HCAR1 Q9BXC0 1/20 0.34
▸ HCRTR1 O43613 2/20 0.33
▸ HCRTR2 O43614 2/20 0.33
▸ MAPK14 Q16539 2/20 0.33
▸ PKM P14618 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ JAK1 P23458 3/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ GABRA1 P14867 1/20 0.32
▸ GABRG2 P18507 1/20 0.32
▸ GABRB3 P28472 1/20 0.32
▸ GABRA5 P31644 1/20 0.32
▸ GABRA3 P34903 1/20 0.32

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
SCHEMBL18113495 0.82 DGAT1 (0.39) TYK2HCRTR1HCRTR2JAK1KCNH2
SCHEMBL23761304 0.80 MAPK14 (0.40) TYK2HCAR1MAPK14JAK1KCNH2
SCHEMBL2276295 0.73 AOC3 (0.48) MEN1KMT2APPARALMNA
SCHEMBL2659856 0.71 AHR (0.45) KDM4EHPGDTSHRHCRTR1MEN1
SCHEMBL2945910 0.71 S100A4 (0.46) LMNA
SCHEMBL1441262 0.70 DGAT1 (0.45) KDM4EPKM
SCHEMBL15868146 0.70 AOC3 (0.37) HPGDTSHRPPARA
SCHEMBL31415394 0.70 PLA2G7 (0.40) TYK2KDM4EHPGDTSHRHCRTR1
SCHEMBL23837827 0.70 IDO1 (0.41) TYK2KDM4EHCAR1HCRTR1HCRTR2
SCHEMBL481810 0.70 CYP4F2 (0.36) CRHR1HPGD

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-117043162-A TYK2 selective inhibitors and uses thereof 迈巴制药(南京)有限公司 2023-11-10 — — CN disclosed
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