SCHEMBL27798998

SCHEMBL27798998

O=CC1CC(c2ccccc2Cl)=NN1c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PRKCZ Q05513 1/20 0.49
▸ MAOA P21397 2/20 0.45
▸ MAOB P27338 2/20 0.45
▸ KIF11 P52732 2/20 0.45
▸ MMP2 P08253 2/20 0.44
▸ MMP9 P14780 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ HSP90AA1 P07900 1/20 0.44
▸ ATM Q13315 1/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ APC P25054 1/20 0.39

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
SCHEMBL27555197 0.81 MEN1 (0.56) PRKCZMAOAMAOBMEN1KMT2A
SCHEMBL27778006 0.75 EGFR (0.55) MAOAMAOBMMP2MMP9MEN1
SCHEMBL27798985 0.75 GAA (0.57) MAOBMEN1KMT2AHSP90AA1ATM
SCHEMBL27692151 0.74 SHMT2 (0.45) PRKCZMAOAMAOBMEN1KMT2A
SCHEMBL25178380 0.73 MAPT (0.48) PRKCZMEN1KMT2AATML3MBTL1
SCHEMBL28203288 0.73 MEN1 (0.38) PRKCZMEN1KMT2AHSP90AA1ATM
SCHEMBL28774867 0.71 MEN1 (0.36) PRKCZMEN1KMT2AHSP90AA1ATM
SCHEMBL28091661 0.71 MEN1 (0.41) MAOAMAOBMEN1KMT2AATM
SCHEMBL29051504 0.70 PTGS1 (0.41) PRKCZMEN1KMT2A
SCHEMBL27712024 0.69 MEN1 (0.37) PRKCZMEN1KMT2AHSP90AA1ATM

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-101691356-A Method for synthesizing Baylis-Hillman addition compound containing 5-chloropyrazolo rings UNIV ZHEJIANG TECHNOLOGY 2010-04-07 — — CN disclosed
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