SCHEMBL14447537

SCHEMBL14447537

Cc1cc2[nH]c(C3CCNCC3)nc2cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 3/20 0.48
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ NPY5R Q15761 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HCRTR1 O43613 10/20 0.40
▸ HCRTR2 O43614 10/20 0.40

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
SCHEMBL5407734 0.88 NPY5R (0.50) NPC1RAB9ANPY5R
SCHEMBL14447476 0.88 NPC1 (0.50) NPC1RAB9AALDH1A1
SCHEMBL19197040 0.85 KCNH2 (0.47) KCNH2ALDH1A1HCRTR1HCRTR2
SCHEMBL14838875 0.77 SCN10A (0.52) NPC1RAB9AHCRTR1HCRTR2
SCHEMBL12209610 0.77 ALDH1A1 (0.57) NPC1RAB9ANPY5RALDH1A1
SCHEMBL2111216 0.77 NPC1 (0.58) NPC1RAB9AALDH1A1
SCHEMBL14447538 0.77 NPC1 (0.51) NPC1RAB9ANPY5RALDH1A1
SCHEMBL4348190 0.76 CACNA1G (0.37) KCNH2HCRTR1HCRTR2
SCHEMBL20992046 0.74 NPC1 (0.68) NPC1RAB9A
SCHEMBL16599521 0.73 NPY5R (0.44) NPC1RAB9ANPY5RALDH1A1

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-7244847-B2 Benzimidazole compounds ISIS PHARMACEUTICALS, INC. (US) 2007-07-17 — — US disclosed
US-7244847-B2 Benzimidazole compounds ISIS PHARMACEUTICALS, INC. (US) 2007-07-17 — — US disclosed
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