SCHEMBL28028583

SCHEMBL28028583

COc1c(CP)ccc(C)c1C

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
MAPT P10636 3/20 0.34
LMNA P02545 2/20 0.34
TSHR P16473 3/20 0.34
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 1/20 0.33
GAA P10253 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPK1 P28482 2/20 0.30
NPC1 O15118 1/20 0.30
ALOX15 P16050 1/20 0.30
HTT P42858 1/20 0.30
GFER P55789 1/20 0.30
TUBB1 Q9H4B7 1/20 0.30
AGXT P21549 1/20 0.30

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
SCHEMBL12560287 0.81 ALDH1A1 (0.35) ALDH1A1MAPTLMNATSHRKDM4E
SCHEMBL5755657 0.75 CYP1A2 (0.31) TSHR
SCHEMBL13027249 0.75 ALDH1A1 (0.32) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL30968870 0.74 ALDH1A1 (0.39) ALDH1A1MAPTLMNATSHRKDM4E
SCHEMBL146614 0.74 ALDH1A1 (0.39) ALDH1A1MAPTLMNATSHRKDM4E
SCHEMBL9117933 0.73 GABRA1 (0.35) ALDH1A1KDM4EMEN1KMT2AGAA
SCHEMBL31357219 0.73 SMN1; SMN2 (0.47) ALDH1A1KDM4EGAATDP1SMN1; SMN2
SCHEMBL13027423 0.73 AOC3 (0.33) ALDH1A1MAPTLMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL22129239 0.73 CYP1A2 (0.30) TSHR
Bromide SCHEMBL22129268 0.73 CYP1A2 (0.30) TSHR

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-104810159-B Preparation method for tin-doped indium phosphide quantum dot sensitized solar cell 中国工程物理研究院材料研究所 2017-04-19 CN disclosed
CN-104810159-A Preparation method for tin-doped indium phosphide quantum dot sensitized solar cell MATERIAL INST CHINA ACADEMY ENGINEERING PHYSICS 2015-07-29 CN disclosed