SCHEMBL5082147

SCHEMBL5082147

CC(C)N(Cc1ccc(-c2ccc(S(C)(=O)=O)cc2)nc1)C1CCNCC1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.44
MLNR O43193 3/20 0.40
CYP2D6 P10635 1/20 0.40
CTSC P53634 1/20 0.40
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 3/20 0.40
GPR119 Q8TDV5 4/20 0.39
SLC6A3 Q01959 1/20 0.39
KCNH2 Q12809 1/20 0.39
PLAT P00750 1/20 0.38
GPR183 P32249 1/20 0.38
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
PTGS2 P35354 3/20 0.37
PTGS1 P23219 1/20 0.37
FYN P06241 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
SCHEMBL5079948 0.87 RORC (0.41) RORCMLNRCYP2D6CTSCSLC6A2
SCHEMBL5079994 0.87 RORC (0.41) RORCMLNRCYP2D6CTSCSLC6A2
SCHEMBL5082880 0.83 DRD3 (0.41) RORCMLNRCYP2D6CTSCSLC6A2
SCHEMBL3978907 0.83 GPR119 (0.47) RORCCTSCGPR119GPR183
SCHEMBL3983311 0.80 GPR119 (0.58) GPR119
SCHEMBL14190985 0.79 GPR119 (0.64) GPR119
SCHEMBL3977929 0.77 CYP4F2 (0.41) RORCMLNRCYP2D6CTSCSLC6A2
SCHEMBL387949 0.75 GPR119 (0.46) GPR119PLATGPR183PTGS2PTGS1
SCHEMBL4048443 0.74 RORC (0.47) RORCGPR119KCNH2PLATNOS3
SCHEMBL14167886 0.73 GPR119 (0.58) SLC6A2SLC6A4GPR119SLC6A3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US disclosed
WO-2008025798-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 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-20080103123-A1 New compounds GPR119, GPR139, GPR180 RORC 154/4885MLNR 168/4885CYP2D6 835/4885

“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.