SCHEMBL29980690

SCHEMBL29980690

O=C(Cc1cccc(F)c1)c1ccc(Br)cc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.49
MAOB P27338 3/20 0.45
PARP15 Q460N3 1/20 0.43
PARP10 Q53GL7 1/20 0.43
HIF1A Q16665 1/20 0.43
CNR2 P34972 1/20 0.43
LMNA P02545 3/20 0.42
NPC1 O15118 2/20 0.42
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
RAB9A P51151 2/20 0.42
ALOX12 P18054 1/20 0.42
EGFR P00533 1/20 0.41
ERBB2 P04626 1/20 0.41
LRRK2 Q5S007 2/20 0.41
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
PIK3CA P42336 1/20 0.40
MAPK8 P45983 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40

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
SCHEMBL30494456 0.84 HPGD (0.47) MAOBCNR2LMNANPC1GAA
SCHEMBL11100 0.84 HPGD (0.47) MAOBCNR2LMNANPC1GAA
SCHEMBL6511713 0.80 GSK3B (0.46) MAOBPARP10GAAMAPTKMT2A
SCHEMBL29980324 0.79 LMNA (0.49) MAOBHIF1ACNR2LMNANPC1
SCHEMBL15022115 0.78 DGAT1 (0.50) DGAT1LMNANPC1GAAMAPT
SCHEMBL1515773 0.76 CES2 (0.53) CNR2LMNANPC1MAPTRAB9A
SCHEMBL10561782 0.76 PIK3CA (0.68) MAOBHIF1ACNR2LMNANPC1
SCHEMBL25808294 0.75 CNR2 (0.45) MAOBHIF1ACNR2MAPTLRRK2
SCHEMBL29980557 0.74 LMNA (0.45) MAOBHIF1ACNR2LMNANPC1
SCHEMBL23754470 0.74 DGAT1 (0.61) DGAT1PARP15PARP10LMNANPC1

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-115141092-A Synthetic method of anti-lymphoma drug related compound 诚达药业股份有限公司 2022-10-04 CN disclosed