SCHEMBL6284233

SCHEMBL6284233

CCOC(=O)[N+]1(c2cccc(-n3cnc4cc(-c5ccoc5)ccc43)c2)CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 14/20 0.41
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
GLA P06280 1/20 0.39
RAB9A P51151 1/20 0.39
TP53 P04637 2/20 0.37
MAPT P10636 1/20 0.37
KDR P35968 1/20 0.36
MAPK1 P28482 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
SCHEMBL2649859 0.79 HPGD (0.47) HPGDKMT2ASMN1; SMN2KDRMAPK1
SCHEMBL7059325 0.78 HPGD (0.41) HPGDKMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL2650204 0.77 HPGD (0.39) HPGDKMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL2652084 0.77 ALDH1A1 (0.44) HPGDKMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL2649465 0.75 HPGD (0.39) HPGDKMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL2652320 0.74 KMT2A (0.45) HPGDKMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL2652583 0.74 ALDH1A1 (0.49) KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL2650199 0.74 HPGD (0.38) HPGDKMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL2649181 0.73 HPGD (0.38) HPGDKMT2AALDH1A1SMN1; SMN2NPC1
SCHEMBL7819821 0.72 KDR (0.49) HPGDALDH1A1KDR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6936613-B2 Benzimidazole derivatives and pharmaceutical compositions comprising these compounds NEUROSEARCH A/S (DK) 2005-08-30 US disclosed
US-20040097570-A1 Novel benzimidazole derivatives and pharmaceutical compositions comprising these compounds NEUROSEARCH A/S 2004-05-20 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-20040097570-A1 Novel benzimidazole derivatives and pharmaceutical compositions comprising these compounds GABRA1, GABRA2, GABRA4 HPGD 1452/4885KMT2A 1116/4885ALDH1A1 977/4885

“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.