SCHEMBL30041255

SCHEMBL30041255

O=C1c2ccccc2C(=O)N1Cc1cc2cc(Br)ccc2nn1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYR P14679 4/20 0.50
PRMT5 O14744 1/20 0.46
WDR77 Q9BQA1 1/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 1/20 0.46
PKM P14618 1/20 0.46
KMT2A Q03164 1/20 0.46
MAPT P10636 3/20 0.44
RECQL P46063 1/20 0.44
GRM5 P41594 1/20 0.41
USP2 O75604 1/20 0.41
GSK3B P49841 1/20 0.40
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP1B1 Q16678 2/20 0.38
ALDH2 P05091 1/20 0.37
ALDH3A1 P30838 1/20 0.37
CASP3 P42574 1/20 0.37

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
SCHEMBL23706172 1.00 TYR (0.50) TYRPRMT5WDR77ALDH1A1MEN1
SCHEMBL30041574 0.78 MEN1 (0.49) TYRPRMT5WDR77ALDH1A1MEN1
SCHEMBL23706090 0.78 MEN1 (0.49) TYRPRMT5WDR77ALDH1A1MEN1
SCHEMBL17293770 0.73 MEN1 (0.64) TYRPRMT5WDR77ALDH1A1MEN1
SCHEMBL6526615 0.72 CYP1B1 (0.53) TYRALDH1A1MEN1PKMKMT2A
SCHEMBL8222291 0.71 MEN1 (0.61) TYRPRMT5WDR77ALDH1A1MEN1
SCHEMBL17979154 0.70 GRM5 (0.51) TYRPRMT5WDR77ALDH1A1MAPT
SCHEMBL29411210 0.70 GRM5 (0.51) TYRPRMT5WDR77ALDH1A1MAPT
SCHEMBL18562311 0.70 PABPC1 (0.42) ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL23706036 0.70 PABPC1 (0.42) ALDH1A1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115297861-B Compounds and uses thereof 福宏治疗公司 2024-07-12 CN disclosed
CN-115297861-A Compound and use thereof 福宏治疗公司 2022-11-04 CN disclosed