SCHEMBL243069

SCHEMBL243069

CC=CC(=O)OCCC1(c2ccccc2)CCO1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
TSHR P16473 2/20 0.40
ICMT O60725 2/20 0.40
AKR1B10 O60218 4/20 0.38
AKR1B1 P15121 4/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
LMNA P02545 2/20 0.37
CYP2C19 P33261 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
OPRM1 P35372 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAOB P27338 1/20 0.35
OPRL1 P41146 1/20 0.35
MMP9 P14780 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34

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
SCHEMBL245007 0.87 GAA (0.40) GAATSHRICMTAKR1B10AKR1B1
SCHEMBL1357280 0.84 THRB (0.48) GAATSHRICMTAKR1B10AKR1B1
SCHEMBL245947 0.79 GAA (0.43) GAATSHRICMTLMNACYP2C19
SCHEMBL245315 0.71 ATM (0.32) HCAR2
SCHEMBL1357941 0.70 THRB (0.43) GAATSHRICMTL3MBTL1LMNA
SCHEMBL26124337 0.69 APEX1 (0.47) AKR1B10AKR1B1LMNAHCAR2ALDH1A1
SCHEMBL244977 0.68
SCHEMBL1845413 0.68 HCAR2 (0.73) TSHRAKR1B10AKR1B1LMNACYP2C19
SCHEMBL1845409 0.68 HCAR2 (0.73) TSHRAKR1B10AKR1B1LMNACYP2C19
SCHEMBL28909719 0.68 POLB (0.41) GAATSHRL3MBTL1LMNACYP2C19

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
US-20120002138-A1 Pattern forming ink composition, light guide plate, light emitting unit and liquid crystal display element having the light emitting unit CHI-MEI CORPORATION 2012-01-05 US disclosed