SCHEMBL28761122

SCHEMBL28761122

CC(P)(Oc1ccccc1O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
TP53 P04637 1/20 0.44
ALDH1A1 P00352 4/20 0.42
HSD17B10 Q99714 3/20 0.42
KDM4E B2RXH2 3/20 0.42
HSD11B1 P28845 1/20 0.40
HSD17B3 P37058 1/20 0.40
HPGD P15428 2/20 0.38
GAA P10253 5/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
JAK2 O60674 2/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 2/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
ESR1 P03372 1/20 0.36
ALOX15 P16050 1/20 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
SCHEMBL9359773 0.83 TSHR (0.48) TSHRCA1CA2TP53ALDH1A1
SCHEMBL1805490 0.74 CA2 (0.56) TSHRCA1CA2TP53ALDH1A1
SCHEMBL24361903 0.74 NOTUM (0.43) TSHRCA1CA2TP53ALDH1A1
SCHEMBL11259009 0.74 HSD17B10 (0.45) TSHRCA1CA2TP53ALDH1A1
SCHEMBL11048995 0.73 HSD11B1 (0.37) TSHRCA1CA2TP53ALDH1A1
SCHEMBL27210420 0.72 ALDH1A1 (0.52) TSHRCA1CA2TP53ALDH1A1
SCHEMBL3022905 0.71 TSHR (0.40) TSHRCA1CA2TP53ALDH1A1
SCHEMBL11002065 0.71 TSHR (0.52) TSHRCA1CA2TP53ALDH1A1
SCHEMBL28056177 0.71 TSHR (0.52) TSHRCA1CA2TP53ALDH1A1
SCHEMBL31398488 0.71 TSHR (0.52) TSHRCA1CA2TP53ALDH1A1

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-114351268-B Preparation method of flame-retardant anti-dripping polyester-nylon composite fiber 浙江昊能科技有限公司 2023-02-28 CN claimed
CN-114351268-A Preparation method of flame-retardant anti-dripping polyester-nylon composite fiber 浙江昊能科技有限公司 2022-04-15 CN claimed
CN-114351268-B Preparation method of flame-retardant anti-dripping polyester-nylon composite fiber 浙江昊能科技有限公司 2023-02-28 CN disclosed
CN-114351268-A Preparation method of flame-retardant anti-dripping polyester-nylon composite fiber 浙江昊能科技有限公司 2022-04-15 CN disclosed