SCHEMBL4158410

SCHEMBL4158410

CCOC(=O)c1nc(C2=C(c3cc(Br)ccc3O)CCC2)ccc1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 7/20 0.38
GABRB3 P28472 7/20 0.38
GABRA5 P31644 7/20 0.38
GABRA2 P47869 4/20 0.38
GABRA1 P14867 3/20 0.38
GABRA3 P34903 3/20 0.38
GABRA6 Q16445 3/20 0.38
PTGER1 P34995 2/20 0.37
GABRB2 P47870 1/20 0.37
TARBP2 Q15633 1/20 0.36
ALDH1A1 P00352 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPC1 O15118 2/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
ATM Q13315 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
CYP2C9 P11712 1/20 0.35

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
SCHEMBL4162657 0.90 KDM4E (0.41) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL4150144 0.89 PTGER1 (0.40) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL4147278 0.85 MAPT (0.39) PTGER1CYP2C9MAPT
SCHEMBL4155969 0.84 PTGER1 (0.54) PTGER1CYP2C9
SCHEMBL4161707 0.82 PTGER1 (0.59) PTGER1CYP2C9
SCHEMBL4159253 0.82 MAPT (0.41) GABRA2GABRB2TARBP2ALDH1A1NPC1
SCHEMBL4156348 0.82 GABRG2 (0.41) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL4154407 0.82 CYP1A2 (0.47) GABRG2GABRB3GABRA5PTGER1ALDH1A1
SCHEMBL4165791 0.81 PTGER1 (0.51) PTGER1CYP2C9
SCHEMBL4154475 0.81 PTGER1 (0.44) PTGER1CYP2C9

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-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 US disclosed
US-20090227591-A1 Cyclopentene compounds GLAXO GROUP LIMITED (GB) 2009-09-10 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-20090227591-A1 Cyclopentene compounds C1R, CYP1B1, ADORA2B GABRG2 2702/4885GABRB3 1196/4885GABRA5 1214/4885

“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.