SCHEMBL7903255

SCHEMBL7903255

COc1cccc(C(C)NN)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASR P41180 6/20 0.58
AOC3 Q16853 3/20 0.57
POLB P06746 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
TAAR1 Q96RJ0 2/20 0.47
CYP3A4 P08684 2/20 0.47
ALDH1A1 P00352 1/20 0.47
ROCK2 O75116 2/20 0.47
ROCK1 Q13464 2/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
PRKG1 Q13976 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47
SLC6A2 P23975 1/20 0.47
HRH2 P25021 1/20 0.47

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
SCHEMBL28508849 1.00 CASR (0.58) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL8285877 0.83 CASR (0.59) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL410129 0.83 CASR (0.59) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL413322 0.83 CASR (0.59) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL10305652 0.83 CASR (0.59) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL7862921 0.83 CASR (0.59) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL19286306 0.83 CASR (0.59) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL13740795 0.81 CASR (0.58) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL12870263 0.81 CASR (0.58) CASRAOC3POLBSMN1; SMN2MEN1
SCHEMBL14438388 0.81 CASR (0.58) CASRAOC3POLBSMN1; SMN2MEN1

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
US-6291485-B1 TREATMENT OF POST-PTCA RESTENOSIS TEIKOKU HORMONE MFG. CO., LTD. (JP) 2001-09-18 US disclosed
EP-1002797-A1 4,5-DIHYDRO- 1H]-BENZ g]INDAZOLE-3-CARBOXYLIC ACID DERIVATIVES TEIKOKU HORMONE MFG. CO., LTD. (JP) 2000-05-24 EP disclosed