SCHEMBL9300372

SCHEMBL9300372

CC(C)(C)[Si](C)(C)OCCCc1cc[nH]c(=O)c1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DUT P33316 3/20 0.47
GPR84 Q9NQS5 1/20 0.39
PLA2G7 Q13093 1/20 0.33
NSD2 O96028 1/20 0.33
ABL1 P00519 1/20 0.33
PPARG P37231 1/20 0.33
RIN1 Q13671 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
HPGDS O60760 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL9299143 0.92 GPR84 (0.43) DUTGPR84NSD2ABL1PPARG
SCHEMBL1781944 0.82 DUT (0.39) DUTGPR84NSD2ABL1PPARG
SCHEMBL15901906 0.78 HDAC1 (0.44) DUTABL1
SCHEMBL8721414 0.73 GPR84 (0.38) GPR84PLA2G7NSD2ABL1PPARG
SCHEMBL2252126 0.72 IDO1 (0.53) DUTL3MBTL1
SCHEMBL13677532 0.72 GPR84 (0.47) GPR84NSD2ABL1PPARGRIN1
SCHEMBL11482682 0.71 DUT (0.37) DUTPPARG
SCHEMBL21068770 0.71 DUT (0.37) DUTPPARG
SCHEMBL21268599 0.71 IDO1 (0.42) DUT
SCHEMBL3168839 0.71 GABRA1 (0.47) HDAC6

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-5296492-A Certain chroman derivatives useful for treating symptoms caused by contraction of smooth muscles, circulatory diseases or epilepsy NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1994-03-22 US disclosed
EP-0518342-A1 Chroman derivatives Nippon Kayaku Kabushiki Kaisha (JP) 1992-12-16 EP disclosed