SCHEMBL3203618

SCHEMBL3203618

COC(=O)c1ccc(-c2csc(SC)n2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPT P10636 3/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 7/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
TP53 P04637 1/20 0.48
TSHR P16473 1/20 0.48
MCL1 Q07820 1/20 0.48
MYC P01106 1/20 0.46
WDR5 P61964 1/20 0.46
RAB9A P51151 7/20 0.45
NPC1 O15118 6/20 0.45
KDM4E B2RXH2 6/20 0.45
GAA P10253 2/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44
SIRT5 Q9NXA8 2/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL5350275 0.81 RAB9A (0.68) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1553078 0.81 ALDH1A1 (0.67) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL28705905 0.81 MEN1 (0.53) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1811618 0.79 MAPT (0.52) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL24590300 0.78 MAPT (0.60) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL31126504 0.78 ALDH1A1 (0.46) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL1746713 0.78 TSHR (0.71) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL4055990 0.77 NPC1 (0.63) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL28712568 0.77 MEN1 (0.51) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1
SCHEMBL19625453 0.77 MEN1 (0.53) MEN1KMT2AMAPTSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1784400-B1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2015-01-14 EP disclosed
EP-1784400-B1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2015-01-14 EP disclosed
US-7705025-B2 Histamine H3 receptor agents, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2010-04-27 US disclosed
US-7705025-B2 Histamine H3 receptor agents, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2010-04-27 US disclosed
US-7705025-B2 Histamine H3 receptor agents, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2010-04-27 US disclosed
US-20100029608-A1 Histamine H3 Receptor Agents, Preparation and Therapeutic Uses FINLEY DON RICHARD 2010-02-04 US disclosed
US-20100029608-A1 Histamine H3 Receptor Agents, Preparation and Therapeutic Uses FINLEY DON RICHARD 2010-02-04 US disclosed
US-20100029608-A1 Histamine H3 Receptor Agents, Preparation and Therapeutic Uses FINLEY DON RICHARD 2010-02-04 US disclosed
US-20090048225-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY 2009-02-19 US disclosed
US-20090048225-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY 2009-02-19 US disclosed
US-20090048225-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY 2009-02-19 US disclosed
EP-1784400-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-05-16 EP disclosed
WO-2006023462-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-03-02 WO 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 (2 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-20090048225-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES HRH3, HRH4, HCRTR1 MEN1 1340/4885KMT2A 109/4885MAPT 756/4885
US-20100029608-A1 Histamine H3 Receptor Agents, Preparation and Therapeutic Uses HRH3, HRH4, HCRTR1 MEN1 1347/4885KMT2A 127/4885MAPT 859/4885

“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.