SCHEMBL4233570

SCHEMBL4233570

CC(C)n1ccc2cc(CC(=O)O)ccc21

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.50
▸ KDM4E B2RXH2 5/20 0.50
▸ HPGD P15428 5/20 0.50
▸ HSD17B10 Q99714 5/20 0.50
▸ MAPT P10636 3/20 0.50
▸ TSHR P16473 3/20 0.48
▸ PTGS2 P35354 3/20 0.47
▸ PTGS1 P23219 1/20 0.45
▸ AKR1C3 P42330 1/20 0.45
▸ AKR1C2 P52895 1/20 0.45
▸ GAA P10253 5/20 0.42
▸ NFKB1 P19838 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ RGS12 O14924 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ THPO P40225 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ GNAI1 P63096 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
SCHEMBL11977074 0.88 PTGS2 (0.47) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL15970997 0.81 MET (0.38) EPHX2PPARGCA2
SCHEMBL5094204 0.80 KDM4E (0.58) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL17680481 0.79 AKR1C3 (0.41) ALDH1A1HPGDMAPTTSHRAKR1C3
SCHEMBL20946442 0.78 MET (0.38) EPHX2PPARGCA2
SCHEMBL10716531 0.77 NOTUM (0.51) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL4740640 0.76 HCAR3 (0.55) KDM4EHPGDHSD17B10EPHX2PPARG
SCHEMBL15971038 0.76 FFAR1 (0.53) AKR1B1
SCHEMBL27602809 0.75 KDM4E (0.53) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL16595470 0.74 HCAR3 (0.42) HPGDEPHX2PPARG

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-20090233910-A1 Npy antagonists, preparation and uses CEREP (FR) 2009-09-17 — — 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-20090233910-A1 Npy antagonists, preparation and uses NPY1R, NPY5R, NPY2R ALDH1A1 4542/4885KDM4E 1604/4885HPGD 1474/4885

“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.

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