SCHEMBL28293603

SCHEMBL28293603

C=CC(=O)OP(=O)(O)CCCC

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
HPGD P15428 1/20 0.50
THRB P10828 3/20 0.39
ZDHHC20 Q5W0Z9 1/20 0.39
ZDHHC2 Q9UIJ5 1/20 0.39
GABBR2 O75899 1/20 0.38
GABRR1 P24046 1/20 0.38
GABBR1 Q9UBS5 1/20 0.38
LPAR3 Q9UBY5 3/20 0.38
LPAR2 Q9HBW0 1/20 0.38
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
CETP P11597 3/20 0.36
THRA P10827 1/20 0.36
ATM Q13315 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
SCHEMBL28013605 0.93 LPAR3 (0.48) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL27363275 0.93 LPAR3 (0.48) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL27735812 0.93 LPAR3 (0.48) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL27995852 0.93 LPAR3 (0.48) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL27776361 0.90 TSHR (0.42) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL27386357 0.82 TSHR (0.41) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL28770213 0.80 TSHR (0.46) TSHRHPGDTHRBZDHHC20ZDHHC2
SCHEMBL28178402 0.79 ATM (0.38) GABBR2GABRR1GABBR1LPAR3LPAR2
SCHEMBL21052653 0.77 TSHR (0.70) TSHRHPGDTHRBGABBR2GABRR1
SCHEMBL27507990 0.77 TSHR (0.55) TSHRHPGDTHRBLPAR3LPAR2

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
CN-109790350-A Copolymer compositions with phosphonate group 株式会社可乐丽 2019-05-21 CN disclosed