SCHEMBL7712258

SCHEMBL7712258

c1cc(CC2CO2)c(Oc2c(CC3CO3)cccc2CC2CO2)c(CC2CO2)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
TP53 P04637 3/20 0.41
TSHR P16473 3/20 0.41
HIF1A Q16665 2/20 0.41
CYP3A4 P08684 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.38
GLA P06280 1/20 0.35
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 2/20 0.30
HPGD P15428 2/20 0.30
CYP1A2 P05177 1/20 0.30
CTSB P07858 1/20 0.30
PPARG P37231 1/20 0.30
DHFR P00374 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL21772327 0.89 ALDH1A1 (0.42) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL19182969 0.87 ALDH1A1 (0.36) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL11373613 0.84 HTR1A (0.41) ALDH1A1TSHRCYP3A4SMN1; SMN2GLA
SCHEMBL5879425 0.84 ALDH1A1 (0.39) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL283604 0.82 ALDH1A1 (0.55) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL14397632 0.82 ALDH1A1 (0.55) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL5879440 0.81 ALDH1A1 (0.41) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL11373628 0.81 ALDH1A1 (0.39) ALDH1A1TSHRGLAMEN1KMT2A
SCHEMBL29826970 0.80 TDP1 (0.45) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL6480647 0.80 TDP1 (0.45) ALDH1A1TP53TSHRHIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023210311-A1 ACTINIC RAY CURABLE INK COMPOSITION AND PRINTED MATTER 東洋インキSCホールディングス株式会社 2023-11-02 WO disclosed
CN-109843965-B Epoxy resin composition for forming printed wiring board 日产化学株式会社 2021-07-27 CN disclosed
US-6369133-B2 A POLYESTER BASED AQUEOUS COATING MIXTURE CONSISTS OF A CARBOXYL-FUNCTIONAL POLYESTER RESIN, A WATER INSOLUBLE EPOXY RESIN, A HYDROPHOBIC SOLVENT, AND THE MIXTURE BEING NEUTRALIZED WITH AMINE NEUTRALIZER, DISSOLVED IN WATER KANSAI PAINT CO., LTD. (JP) 2002-04-09 US disclosed
US-20010047057-A1 Polyester-based aqueous coating composition KANSAI PAINT CO., LTD. (JP) 2001-11-29 US disclosed
US-6166100-A Cationically polymerizable pigmented composition KANSAI PAINT CO., LTD. (JP) 2000-12-26 US disclosed