SCHEMBL4924730

SCHEMBL4924730

CCOC(=O)c1cccc(C2=C(O)CCCC2)n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.59
MAPT P10636 1/20 0.49
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
TSHR P16473 1/20 0.37
P2RY12 Q9H244 1/20 0.37
KDM4E B2RXH2 3/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL4165889 0.83 CYP1A2 (0.57) CYP1A2MAPTCA12CA1CA2
SCHEMBL4922618 0.80 CYP1A2 (0.47) CYP1A2MAPTCA12CA1CA2
SCHEMBL4922487 0.80 CYP1A2 (0.47) CYP1A2MAPTALDH1A1KDM4EGABRA2
SCHEMBL4923023 0.80 CYP1A2 (0.39) CYP1A2MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL5620136 0.79 CYP1A2 (0.49) CYP1A2MAPTCA12CA1CA2
SCHEMBL4159378 0.77 CYP1A2 (0.50) CYP1A2MAPTHPGDSMN1; SMN2ALDH1A1
SCHEMBL4147291 0.77 PTGER1 (0.49) CYP1A2MAPTALDH1A1KDM4EGABRA2
SCHEMBL4926085 0.77 CYP1A2 (0.47) CYP1A2MAPTCA12CA1CA2
SCHEMBL4154407 0.77 CYP1A2 (0.47) CYP1A2MAPTCA12CA1CA2
SCHEMBL4154611 0.77 CYP1A2 (0.47) CYP1A2MAPTCA12CA1CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080234335-A1 Cyclohexene Compounds GLAXO GROUP LIMITED (GB) 2008-09-25 US disclosed
EP-1670764-A1 CYCLOHEXENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2006-06-21 EP disclosed
WO-2005037794-A1 CYCLOHEXENE COMPOUNDS GLAXO GROUP LIMITED (GB) 2005-04-28 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-20080234335-A1 Cyclohexene Compounds C1R, CYP1B1, CYP2C9 CYP1A2 51/4885MAPT 4485/4885CA12 2692/4885

“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.