SCHEMBL2190679

SCHEMBL2190679

CC1(C(=O)OC23CC4CC(CC(C4)C2)C3)CC2C=CC1C2

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.36
CYP19A1 P11511 6/20 0.35
CYP17A1 P05093 5/20 0.33
NAAA Q02083 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
RAB9A P51151 1/20 0.33
CETP P11597 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPSR1 Q6W5P4 2/20 0.32
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
CA2 P00918 1/20 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
SCHEMBL18938394 0.79 P2RX7 (0.41) P2RX7CETPCYP2D6CYP2C19NPSR1
SCHEMBL200115 0.79 P2RX7 (0.41) P2RX7CETPCYP2D6CYP2C19NPSR1
SCHEMBL8961379 0.77 P2RX7 (0.32) P2RX7
SCHEMBL565525 0.77 HSD11B1 (0.35) P2RX7CYP2D6CYP2C19
Ethylene SCHEMBL20471720 0.76 P2RX7 (0.40) P2RX7CETPCYP2D6CYP2C19NPSR1
SCHEMBL8961432 0.76 P2RX7 (0.31) P2RX7
SCHEMBL5459313 0.76 P2RX7 (0.38) P2RX7CETPCYP2D6CYP2C19
SCHEMBL1451420 0.75 P2RX7 (0.37) P2RX7CETPCYP2D6CYP2C19MEN1
SCHEMBL5456663 0.75 P2RX7 (0.39) P2RX7CETPCYP2D6CYP2C19
SCHEMBL200228 0.75 CYP2C19 (0.40) P2RX7CETPCYP2D6CYP2C19

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110171586-A1 RESIST PROCESSING METHOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-07-14 US disclosed
US-6849375-B2 Photoresist monomers, polymers thereof and photoresist compositions containing the same HYNIX SEMICONDUCTOR INC. (KR) 2005-02-01 US disclosed
US-20030022101-A1 Photoresist monomers, polymers thereof and photoresist compositions containing the same INTELLECTUAL DISCOVERY CO. LTD. (KR) 2003-01-30 US disclosed