SCHEMBL7590486

SCHEMBL7590486

c1cc2cc(OC[C@H]3CO3)ccc2o1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.56
TP53 P04637 3/20 0.56
TSHR P16473 3/20 0.56
HIF1A Q16665 2/20 0.56
CYP3A4 P08684 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TDP1 Q9NUW8 1/20 0.49
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PKM P14618 2/20 0.46
CYP1A2 P05177 1/20 0.46
PPARG P37231 1/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.46
MRGPRX4 Q96LA9 1/20 0.44
FGFR1 P11362 1/20 0.41
SRC P12931 1/20 0.41
CYP2A6 P11509 2/20 0.40

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
SCHEMBL1715242 0.83 ALDH1A1 (0.71) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL1602850 0.83 SLC6A2 (0.48) MRGPRX4CYP2A6CHRNB4CHRNA3CHRNA7
SCHEMBL1602263 0.80 PARP10 (0.47) MRGPRX4CA12
SCHEMBL7793951 0.80 ALDH1A1 (0.67) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL29366782 0.80 ALDH1A1 (0.67) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL12441429 0.80 ALDH1A1 (0.67) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL18125579 0.80 ALDH1A1 (0.67) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL13255877 0.77 ALDH1A1 (0.62) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL844653 0.77 ALDH1A1 (0.68) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL4620895 0.77 ALDH1A1 (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6465501-B2 USEFUL IN TREATING OR INHIBITING METABOLIC DISORDERS RELATED TO INSULIN RESISTANCE OR HYPERGLYCEMIA, ATHEROSCLEROSIS, GASTROINTESTINAL DISORDERS, NEUROGENETIC INFLAMMATION, GLAUCOMA, OCULAR HYPERTENSION AND INCONTINENCE WYETH 2002-10-15 US disclosed
US-20020032222-A1 Azolidines as beta-3 adrenergic receptor agonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-03-14 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-20020032222-A1 Azolidines as beta-3 adrenergic receptor agonists GPR119, ADRB1, ADRB3 ALDH1A1 1058/4885TP53 4330/4885TSHR 374/4885

“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.