SCHEMBL29664007

SCHEMBL29664007

Cc1ccc2c(c1)C(C)(C)c1cc(O)c3ccc(Br)cc3c1-2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.34
CSNK2B P67870 1/20 0.34
CSNK2A1 P68400 1/20 0.34
PIM1 P11309 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ESR2 Q92731 1/20 0.32
PDK2 Q15119 1/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
ATM Q13315 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALK Q9UM73 5/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31

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
SCHEMBL1962962 1.00 CSNK2A2 (0.34) CSNK2A2CSNK2BCSNK2A1PIM1MAOA
SCHEMBL10134245 0.84 PDK2 (0.35) PDK2CASP3RAB9AATMNPSR1
SCHEMBL30104207 0.83 ALDH1A1 (0.34) PIM1PDK2ALKKMT2ABIRC5
SCHEMBL30104206 0.83 PPM1A (0.37) ALKMEN1KMT2A
SCHEMBL1963833 0.83 ALDH1A1 (0.34) PIM1PDK2ALKKMT2ABIRC5
SCHEMBL23572603 0.83 PPM1A (0.37) ALKMEN1KMT2A
SCHEMBL2630542 0.83 RAB9A (0.40) PDK2CASP3RAB9AATMNPSR1
SCHEMBL23572608 0.82 MAPT (0.36) ESR2PDK2MEN1KMT2A
SCHEMBL30104205 0.82 MAPT (0.36) ESR2PDK2MEN1KMT2A
SCHEMBL160603 0.82 PDK2 (0.37) PIM1PDK2MEN1KMT2ABCL2

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-107253943-B Photochromic compounds and compositions 光学转变公司 2022-05-17 CN disclosed