SCHEMBL1856113

SCHEMBL1856113

Cc1[nH]n[c]c1CCN1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 9/20 0.42
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
SIGMAR1 Q99720 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
HRH1 P35367 1/20 0.38
SLC6A3 Q01959 1/20 0.37
MBTD1 Q05BQ5 1/20 0.36
L3MBTL3 Q96JM7 1/20 0.36

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
SCHEMBL1854770 0.66 CYP1A2 (0.43) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL2643824 0.63 HRH3 (0.38) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL1853593 0.63 HRH3 (0.42) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL19661490 0.62 HRH3 (0.96) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL19661165 0.62 HRH3 (0.96) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL81429 0.62 HRH3 (0.96) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL19661488 0.62 HRH3 (0.96) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL18923722 0.62 HRH3 (0.96) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL20820999 0.62 HRH3 (0.96) HRH3CYP1A2CYP3A4SIGMAR1L3MBTL1
SCHEMBL2056177 0.62 HRH3 (0.52) HRH3CYP1A2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242116-B2 Fused thiazole derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2012-08-14 US disclosed
EP-2035436-B1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA SA (BE) 2011-05-25 EP disclosed
US-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors UCB PHARMA S.A. (BE) 2010-06-03 US disclosed
WO-2009122148-A1 FUSED THIOPHENE AND THIAZOLE DERIVATIVES AS PI3K KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-10-08 WO disclosed
WO-2009071888-A1 PYRROLOTHIAZOLES AS PI3-KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071895-A1 FUSED THIAZOLE AND THIOPHENE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
WO-2009071890-A1 TRICYCLIC KINASE INHIBITORS UCB PHARMA S.A. (BE) 2009-06-11 WO disclosed
EP-2035436-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB Pharma S.A. (BE) 2009-03-18 EP disclosed
WO-2008001076-A1 FUSED THIAZOLE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2008-01-03 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 (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-20100137302-A1 Fused Thiazole Derivatives as Kinase Inhibitors PI4KA, PDPK1, PIK3CA HRH3 1487/4885CYP1A2 2905/4885CYP3A4 1423/4885

“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.