SCHEMBL7242552

SCHEMBL7242552

CCCOC(=O)c1ccc2c(c1)ncn2-c1cccc(N2CCN(C)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 15/20 0.56
FGFR1 P11362 4/20 0.51
ALDH1A1 P00352 4/20 0.47
NPC1 O15118 1/20 0.47
GLA P06280 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL2651498 0.93 HPGD (0.56) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL6752588 0.92 HPGD (0.54) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2649744 0.92 HPGD (0.60) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2651819 0.91 HPGD (0.55) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL7241895 0.91 HPGD (0.56) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL5813161 0.90 HPGD (0.52) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2654761 0.90 HPGD (0.53) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2647587 0.87 FGFR1 (0.68) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2662138 0.85 FGFR1 (0.46) HPGDFGFR1ALDH1A1NPC1GLA
SCHEMBL2944419 0.85 HPGD (0.58) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030166638-A1 Benzimidazole's used as aminobutyric acid receptor modulators, for prophylaxis of nervous system disorders such as anxiety, sleep disorders, epilepsia or convulsions NEUROSEARCH A/S 2003-09-04 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-20030166638-A1 Benzimidazole's used as aminobutyric acid receptor modulators, for prophylaxis of nervous system disorders such as anxiety, sleep disorders, epilepsia or convulsions GABRA1, GABRA2, GABRA4 HPGD 1806/4885FGFR1 3464/4885ALDH1A1 192/4885

“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.