SCHEMBL10307791

SCHEMBL10307791

COOCc1cc(=O)c2c(OCC(O)COc3cccc4oc(C(=O)OC)cc(=O)c34)cccc2o1

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GPR35 Q9HC97 3/20 0.62
▸ LMNA P02545 1/20 0.62
▸ TDP1 Q9NUW8 1/20 0.62
▸ MEN1 O00255 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ HIF1A Q16665 1/20 0.60
▸ ABCG2 Q9UNQ0 12/20 0.43
▸ ABCB1 P08183 2/20 0.42
▸ ADRB2 P07550 3/20 0.41
▸ NMT2 O60551 2/20 0.41
▸ ADRB1 P08588 2/20 0.41
▸ ADRB3 P13945 2/20 0.41
▸ NMT1 P30419 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ USP2 O75604 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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
SCHEMBL10307768 0.91 GPR35 (0.50) GPR35LMNATDP1MEN1KMT2A
SCHEMBL15452216 0.90 GPR35 (0.76) GPR35LMNATDP1MEN1KMT2A
SCHEMBL14473271 0.86 GPR35 (0.84) GPR35LMNATDP1MEN1KMT2A
SCHEMBL22877930 0.86 GPR35 (0.69) GPR35LMNATDP1MEN1KMT2A
SCHEMBL10307544 0.85 GPR35 (0.68) GPR35LMNATDP1MEN1KMT2A
SCHEMBL14544412 0.83 GPR35 (0.65) GPR35LMNATDP1MEN1KMT2A
SCHEMBL25669932 0.80 GPR35 (0.64) GPR35LMNATDP1MEN1KMT2A
SCHEMBL15452215 0.80 GPR35 (0.60) GPR35LMNATDP1MEN1KMT2A
SCHEMBL26848550 0.80 GPR35 (0.74) GPR35LMNATDP1MEN1KMT2A
SCHEMBL19935517 0.79 GPR35 (0.62) GPR35LMNATDP1MEN1KMT2A

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
US-20120177730-A1 Chemosensory Receptor Ligand-Based Therapies ELCELYX THERAPEUTICS, INC. (US) 2012-07-12 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120177730-A1 Chemosensory Receptor Ligand-Based Therapies TAS1R2, TAS2R1, GPR119 GPR35 190/4885LMNA 3720/4885TDP1 3023/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

Send feedback