SCHEMBL2653095

SCHEMBL2653095

CCCOC(C)c1ccc2c(c1)ncn2-c1cccc(N2CCCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 6/20 0.47
HPGD P15428 10/20 0.45
ALDH1A1 P00352 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
GLA P06280 1/20 0.40
RAB9A P51151 1/20 0.40
SRC P12931 3/20 0.40
KDR P35968 2/20 0.40
MAPK1 P28482 1/20 0.38

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
SCHEMBL2653282 0.92 HPGD (0.46) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL13917313 0.88 HPGD (0.44) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL2653360 0.86 HPGD (0.48) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL2660047 0.86 HPGD (0.48) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL2653515 0.86 HPGD (0.43) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL2653646 0.84 FGFR1 (0.47) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL2656896 0.82 FGFR1 (0.45) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL5929894 0.82 HPGD (0.53) FGFR1HPGDALDH1A1SMN1; SMN2NPC1
SCHEMBL2653663 0.80 HPGD (0.46) HPGDALDH1A1SMN1; SMN2NPC1GLA
SCHEMBL2653642 0.78 FGFR1 (0.47) FGFR1HPGDALDH1A1SMN1; SMN2NPC1

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 4 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 claimed
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 FGFR1 3374/4885HPGD 2466/4885ALDH1A1 477/4885

“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.