SCHEMBL2653515

SCHEMBL2653515

CC(OCC1CC1)c1ccc2c(c1)ncn2-c1cccc(N2CCCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 14/20 0.43
FGFR1 P11362 3/20 0.39
ALDH1A1 P00352 2/20 0.39
NPC1 O15118 1/20 0.39
GLA P06280 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SRC P12931 2/20 0.38
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
KDR P35968 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
SCHEMBL2653282 0.88 HPGD (0.46) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2653095 0.86 FGFR1 (0.47) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL5929969 0.85 HPGD (0.40) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2653360 0.84 HPGD (0.48) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2660047 0.84 HPGD (0.48) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2662404 0.84 FGFR1 (0.38) HPGDFGFR1ALDH1A1RAB9ASMN1; SMN2
SCHEMBL5929894 0.80 HPGD (0.53) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL5930023 0.80 FGFR1 (0.37) HPGDFGFR1SMN1; SMN2SRCTP53
SCHEMBL5929965 0.78 HPGD (0.43) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL5929760 0.77 KDR (0.39) HPGDFGFR1ALDH1A1NPC1GLA

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 claimed
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 claimed
WO-2004087690-A2 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABA-A RECEPTOR COMPLEX NEUROSEARCH A/S (DK) 2004-10-14 WO claimed

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 3374/4885ALDH1A1 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.