SCHEMBL29466047

SCHEMBL29466047

Oc1c(Sc2ccc3ccccc3c2O)ccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTPN22 Q9Y2R2 1/20 0.58
▸ LDHA P00338 1/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ CYP2A6 P11509 1/20 0.48
▸ TSHR P16473 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ USP2 O75604 1/20 0.47
▸ PAK1 Q13153 1/20 0.47
▸ CYP1A2 P05177 2/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ HPRT1 P00492 1/20 0.44
▸ POLB P06746 1/20 0.43

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
SCHEMBL2434774 1.00 PTPN22 (0.58) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL30187599 0.86 PTPN22 (0.58) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL2233625 0.86 PTPN22 (0.58) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL6754155 0.84 PTPN22 (0.56) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL6035055 0.83 PTPN22 (0.54) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL3198488 0.83 PTPN22 (0.54) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL11467447 0.83 PTPN22 (0.54) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL22284132 0.81 ALDH1A1 (0.41) PTPN22HSD17B10ALDH1A1TDP1USP2
SCHEMBL28572809 0.79 PTPN22 (0.50) PTPN22LDHAHSD17B10ALDH1A1CYP2A6
SCHEMBL4969506 0.79 PTPN22 (0.50) PTPN22LDHAHSD17B10ALDH1A1CYP2A6

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
CN-111349397-B Pale rosin and rosin ester compositions 科腾聚合物有限责任公司 2023-09-12 — — CN claimed
CN-110799598-B Light-colored rosin ester composition and preparation method thereof 科腾聚合物有限责任公司 2022-03-29 — — CN claimed
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