SCHEMBL10193068

SCHEMBL10193068

Bc1ccc2sc(CCO)nc2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.46
LOXL2 Q9Y4K0 1/20 0.41
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 1/20 0.37
TRPV1 Q8NER1 6/20 0.36
UBE2T Q9NPD8 1/20 0.35
ASIC3 Q9UHC3 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
SCHEMBL10193069 0.83 HDAC6 (0.46) HDAC6LOXL2RAB9ANPC1GAA
SCHEMBL489036 0.80 TRPV1 (0.48) HDAC6LOXL2HSD17B10RAB9ANPC1
SCHEMBL3919004 0.75 UBE2T (0.61) HSD17B10RAB9ANPC1GAAMAPK1
SCHEMBL489018 0.70 RAB9A (0.47) HDAC6RAB9ANPC1GAAHTT
SCHEMBL10254309 0.69 ALDH1A1 (0.57) HSD17B10RAB9ANPC1GAAHTT
SCHEMBL13539291 0.69 PIK3CA (0.54) HSD17B10RAB9ANPC1GAAHTT
SCHEMBL13986778 0.66 TRPV1 (0.55) HDAC6LOXL2HSD17B10RAB9ANPC1
SCHEMBL14327114 0.66 SMN1; SMN2 (0.65) HSD17B10GAAALOX15SMN1; SMN2HPGD
SCHEMBL21104587 0.66 LOXL2 (0.70) HDAC6LOXL2GAASMN1; SMN2TRPV1
SCHEMBL14835424 0.66 SMN1; SMN2 (0.67) HSD17B10RAB9ANPC1GAAMAPK1

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-8106088-B2 Fused bicyclic-substituted amines as histamine-3 receptor ligands ABBOTT LABORATORIES (US) 2012-01-31 US disclosed
US-20100298291-A1 FUSED BICYCLIC-SUBSTITUTED AMINES AS HISTAMINE-3 RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2010-11-25 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-20100298291-A1 FUSED BICYCLIC-SUBSTITUTED AMINES AS HISTAMINE-3 RECEPTOR LIGANDS HRH3, HRH4, HRH2 HDAC6 1276/4885LOXL2 1889/4885HSD17B10 3246/4885

“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.