SCHEMBL3979014

SCHEMBL3979014

CC(=O)c1cccc(C(=O)N2CCC(COc3ccc(-c4ccc(S(C)(=O)=O)cc4)cn3)CC2)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 2/20 0.44
ABL1 P00519 1/20 0.41
BCR P11274 1/20 0.41
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
PIK3CG P48736 1/20 0.40
P2RX7 Q99572 3/20 0.40
CA2 P00918 1/20 0.39
GPR119 Q8TDV5 1/20 0.39
DCPS Q96C86 1/20 0.39
MGLL Q99685 2/20 0.39
CHEK2 O96017 1/20 0.39
GABRA5 P31644 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL3983052 0.90 LMNA (0.46) PIK3CDCA2CHEK2GABRA5
SCHEMBL5082747 0.89 ABL1 (0.49) ABL1BCRP2RX7MGLLFAAH
SCHEMBL3982670 0.89 P2RX7 (0.50) SLC6A9ABL1BCRP2RX7
SCHEMBL3982419 0.85 ACHE (0.39) SLC6A9P2RX7CA2GPR119GABRA5
Trifluoroacetic Acid SCHEMBL3981558 0.84 CACNA1B (0.46) ABL1BCRP2RX7MGLLFAAH
SCHEMBL3986213 0.83 PTGS1 (0.43) GPR119
SCHEMBL3982560 0.82 GAA (0.45) GABRA5
SCHEMBL3980234 0.81 GPR119 (0.44) PIK3CAP2RX7GPR119CHEK2
SCHEMBL3988159 0.80 LIPE (0.43) GPR119GABRA5
SCHEMBL3979634 0.80 ATM (0.39) SLC6A9CA2GPR119

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
EP-2059516-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (publ) (SE) 2009-05-20 EP claimed
US-20080103123-A1 New compounds BIOVITRUM (SE) 2008-05-01 US claimed
WO-2008025798-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (PUBL) (SE) 2008-03-06 WO claimed
EP-2059516-A1 PYRIDINE COMPOUNDS FOR TREATING GPR119 RELATED DISORDERS BIOVITRUM AB (publ) (SE) 2009-05-20 EP 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
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
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 SLC6A9 918/4885ABL1 3190/4885BCR 3269/4885

“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.