SCHEMBL5404653

SCHEMBL5404653

C=C(OC)C(=O)OC1CCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.47
NAAA Q02083 2/20 0.40
HTT P42858 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.37
CYP2C19 P33261 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
GPR35 Q9HC97 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
CYP19A1 P11511 2/20 0.35
FABP7 O15540 1/20 0.35
FABP5 Q01469 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL324473 0.83 EPHX1 (0.42) EPHX1NAAAHTTCYP2C19CA12
SCHEMBL1584701 0.81 EPHX1 (0.52) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL2059955 0.81 ALDH1A1 (0.56) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL974950 0.81 ALDH1A1 (0.56) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL1999691 0.79 EPHX1 (0.47) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL18822970 0.79 EPHX1 (0.46) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL16297135 0.79 EPHX1 (0.46) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL887989 0.79 EPHX1 (0.46) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL1052594 0.79 EPHX1 (0.46) EPHX1NAAAHTTSMN1; SMN2CYP2C19
SCHEMBL28878275 0.79 EPHX1 (0.46) EPHX1NAAAHTTSMN1; SMN2CYP2C19

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-7285373-B2 Polymer and chemically amplified resist composition containing the same KOREA KUMHO PETROCHEMICAL CO., LTD (KR) 2007-10-23 US disclosed
US-20050153236-A1 Novel polymer and chemically amplified resist composition containing the same KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2005-07-14 US disclosed