SCHEMBL27602147

SCHEMBL27602147

CCCC(C)(C)CCC(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.50
ALDH1A1 P00352 3/20 0.39
CA12 O43570 3/20 0.39
CA14 Q9ULX7 3/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
LMNA P02545 3/20 0.38
KDM4E B2RXH2 1/20 0.38
RECQL P46063 1/20 0.38
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37
HSD17B10 Q99714 3/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
MGAM O43451 2/20 0.36
GAA P10253 2/20 0.36
SI P14410 2/20 0.36

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
SCHEMBL28695618 0.91 TSHR (0.60) TSHRALDH1A1CA12CA14KMT2A
SCHEMBL10681064 0.84 TSHR (0.52) TSHRALDH1A1CA12CA14KMT2A
SCHEMBL21016162 0.84 TSHR (0.52) TSHRALDH1A1CA12CA14KMT2A
Ammonia Solution, Strong SCHEMBL28823524 0.83 CA12 (0.46) TSHRCA12CA14KMT2AMEN1
SCHEMBL29060177 0.83 TSHR (0.50) TSHRALDH1A1CA12CA14KMT2A
SCHEMBL3281119 0.83 TSHR (0.50) TSHRALDH1A1CA12CA14KMT2A
SCHEMBL28695620 0.83 TSHR (0.56) TSHRALDH1A1CA12CA14KMT2A
SCHEMBL24606375 0.81 ALDH1A1 (0.34) ALDH1A1LMNAHSD17B10MGAMGAA
SCHEMBL27355541 0.81 TSHR (0.48) TSHRALDH1A1CA12CA14KMT2A
SCHEMBL2200374 0.80 TSHR (0.52) TSHRALDH1A1CA12CA14KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109952360-B Quantum dot dispersion, self-luminous photosensitive resin composition, color filter manufactured using the same, and image display device 东友精细化工有限公司 2022-03-22 CN disclosed
CN-100462351-C Amino acids having affinity for the alpha 2 delta protein WARNER LAMBERT CO (US) 2009-02-18 CN disclosed
CN-1817854-A Amino acids with affinity for the alpha-2-delta protein WARNER LAMBERT CO (US) 2006-08-16 CN disclosed
CN-1653036-A Amino acids having affinity for the alpha 2 delta protein WARNER LAMBERT CO (US) 2005-08-10 CN disclosed