SCHEMBL2655083

SCHEMBL2655083

c1cc(-c2ccon2)cc(-n2cnc3cc(C4OCCO4)ccc32)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 10/20 0.38
FGFR1 P11362 6/20 0.38
SRC P12931 1/20 0.38
GABRA1 P14867 1/20 0.37
GABRG2 P18507 1/20 0.37
GABRB3 P28472 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
ALDH1A1 P00352 3/20 0.35
NPC1 O15118 1/20 0.35
GLA P06280 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL2653249 0.87 HPGD (0.38) HPGDFGFR1SRCGABRA1GABRG2
SCHEMBL2654543 0.78 HPGD (0.37) HPGDFGFR1SRCGABRA1GABRG2
SCHEMBL2654495 0.78 FGFR1 (0.41) HPGDFGFR1SRCALDH1A1NPC1
SCHEMBL2654673 0.78 FGFR1 (0.53) HPGDFGFR1GABRA1GABRG2GABRB3
SCHEMBL2654510 0.78 GABRA1 (0.40) HPGDFGFR1SRCGABRA1GABRG2
SCHEMBL2665437 0.76 GABRA1 (0.41) HPGDFGFR1SRCGABRA1GABRG2
SCHEMBL2645149 0.76 HTT (0.39) HPGDFGFR1GABRA1GABRG2GABRB3
SCHEMBL2643019 0.76 GABRA1 (0.52) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2654024 0.76 FGFR1 (0.62) HPGDFGFR1GABRA1GABRG2GABRB3
SCHEMBL8232331 0.76 MEN1 (0.43) HPGDFGFR1ALDH1A1

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-20060069135-A1 Benzimidazole derivatives and their use for modulating the gaba-a receptor complex NEUROSEARCH A/S (DK) 2006-03-30 US disclosed
EP-1613618-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABA- sb A /sb RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2006-01-11 EP disclosed
WO-2004087690-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABA-A RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2004-10-14 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-20060069135-A1 Benzimidazole derivatives and their use for modulating the gaba-a receptor complex GABRB2, GABRB1, GABRB3 HPGD 2466/4885FGFR1 3374/4885SRC 3558/4885

“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.