SCHEMBL7535664

SCHEMBL7535664

N=C([CH]c1ccc(O)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.47
CA2 P00918 3/20 0.47
AKR1B10 O60218 2/20 0.47
AKR1B1 P15121 2/20 0.47
PKM P14618 2/20 0.47
CA12 O43570 2/20 0.47
CA1 P00915 2/20 0.47
CA3 P07451 2/20 0.47
CA4 P22748 2/20 0.47
CA6 P23280 2/20 0.47
CA5A P35218 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
CA14 Q9ULX7 2/20 0.47
CA5B Q9Y2D0 2/20 0.47
ESR1 P03372 1/20 0.47
DPP4 P27487 1/20 0.47
HCAR2 Q8TDS4 1/20 0.47
ESR2 Q92731 1/20 0.47
ALDH5A1 P51649 1/20 0.44

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
SCHEMBL7191616 0.77 TYR (0.60) TYRCA2AKR1B10AKR1B1PKM
SCHEMBL6523405 0.74 TYR (0.47) TYRCA2AKR1B10AKR1B1PKM
SCHEMBL4147484 0.72 ALDH5A1 (0.52) TYRCA2AKR1B10AKR1B1PKM
SCHEMBL28187249 0.70 ALDH1A1 (0.56) TYRCA2AKR1B10AKR1B1PKM
SCHEMBL5900821 0.70 LMNA (0.48) TYRCA2AKR1B1PKMCA12
Hydroquinone SCHEMBL28408333 0.69 CPT1B (0.63) TYRCA2AKR1B10AKR1B1PKM
SCHEMBL1704759 0.68 ALDH1A1 (0.65) TYRCA2AKR1B10AKR1B1PKM
SCHEMBL2506329 0.68 KDM4E (0.57) TYRCA2AKR1B10AKR1B1PKM
SCHEMBL2506324 0.68 KDM4E (0.57) TYRCA2AKR1B10AKR1B1PKM
4-Hydroxybenzaldehyde SCHEMBL28616388 0.67 ALDH5A1 (0.84) TYRCA2AKR1B10AKR1B1PKM

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-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 TYR 7/4885CA2 1428/4885AKR1B10 3351/4885

“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.