SCHEMBL5881889

SCHEMBL5881889

CCOc1ccc(CC(=O)O)cn1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.60
GABRP O00591 1/20 0.54
GABRD O14764 1/20 0.54
GABRA1 P14867 1/20 0.54
GABRB1 P18505 1/20 0.54
GABRG2 P18507 1/20 0.54
GABRB3 P28472 1/20 0.54
GABRA5 P31644 1/20 0.54
GABRA3 P34903 1/20 0.54
GABRA2 P47869 1/20 0.54
GABRB2 P47870 1/20 0.54
GABRA4 P48169 1/20 0.54
GABRE P78334 1/20 0.54
GABRA6 Q16445 1/20 0.54
GABRG1 Q8N1C3 1/20 0.54
GABRG3 Q99928 1/20 0.54
GABRQ Q9UN88 1/20 0.54
P4HTM Q9NXG6 1/20 0.54
THRB P10828 1/20 0.46
ACACB O00763 4/20 0.46

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
SCHEMBL2491663 0.84 GABRP (0.56) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL29589262 0.84 GABRP (0.56) MAPTGABRPGABRDGABRA1GABRB1
Hydrazine SCHEMBL4704048 0.81 GABRP (0.57) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL5249123 0.81 GABRP (0.56) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL4012600 0.80 MAPT (0.49) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL9388074 0.79 L3MBTL1 (0.63) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL2488282 0.78 MAPT (0.53) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL12141547 0.77 MAPT (0.52) MAPTGABRPGABRDGABRA1GABRB1
SCHEMBL7452934 0.77 SRD5A2 (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL796493 0.75 MAPT (1.00) MAPTGABRPGABRDGABRA1GABRB1

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
US-20060135554-A1 Novel compounds ASTRAZENECA AB (SE) 2006-06-22 US disclosed
US-7030139-B2 Compounds ASTRAZENECA AB (SE) 2006-04-18 US disclosed
US-20040116465-A1 Novel compounds ASTRAZENECA AB (SE) 2004-06-17 US disclosed
EP-1390350-A1 NOVEL COMPOUNDS AstraZeneca AB (SE) 2004-02-25 EP disclosed
WO-2002085866-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2002-10-31 WO 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-20060135554-A1 Novel compounds OPRL1, OPRK1, TRPV1 MAPT 3276/4885GABRP 760/4885GABRD 1205/4885

“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.