SCHEMBL9901036

SCHEMBL9901036

C=CC1CCCCNC1=O.C=CC1CCCCNC1=O

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 12/20 0.43
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 2/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
FKBP5 Q13451 1/20 0.33
CRBN Q96SW2 1/20 0.33

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
SCHEMBL34015 1.00 CCR2 (0.43) CCR2HTTL3MBTL1ALDH1A1RAB9A
SCHEMBL5507855 0.98 CCR2 (0.42) CCR2HTTL3MBTL1ALDH1A1RAB9A
Ammonia Solution, Strong SCHEMBL28119586 0.98 CCR2 (0.42) CCR2HTTL3MBTL1ALDH1A1RAB9A
SCHEMBL31074860 0.98 CCR2 (0.42) CCR2HTTL3MBTL1ALDH1A1RAB9A
SCHEMBL17101670 0.98 CCR2 (0.42) CCR2HTTL3MBTL1ALDH1A1RAB9A
SCHEMBL2549849 0.98 CCR2 (0.42) CCR2HTTL3MBTL1ALDH1A1RAB9A
SCHEMBL29221977 0.98 CCR2 (0.42) CCR2HTTL3MBTL1ALDH1A1RAB9A
SCHEMBL5155720 0.94
Carbon Tetrachloride SCHEMBL31087249 0.93 CCR2 (0.43) CCR2HTTL3MBTL1RAB9A
Ethylene Glycol SCHEMBL28967822 0.91 CCR2 (0.45) CCR2HTTL3MBTL1RAB9A

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
WO-2012078961-A1 COMPOSITIONS COMPRISING STABILIZED KETO-ENOL UV ABSORBERS ISP INVESTMENT INS. (US) 2012-06-14 WO disclosed