SCHEMBL2648055

SCHEMBL2648055

O=C(O)CCNC(=O)c1ccc(C(=O)/C(=C/C(=O)c2ccccc2)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
CYP2D6 P10635 1/20 0.46
GCGR P47871 2/20 0.44
TAOK1 Q7L7X3 1/20 0.44
TAOK3 Q9H2K8 1/20 0.44
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.43
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
BLM P54132 1/20 0.41
KMT2A Q03164 1/20 0.41
GPR35 Q9HC97 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
PRSS1 P07477 1/20 0.41
CTSG P08311 1/20 0.41
CTRB1 P17538 1/20 0.41

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
SCHEMBL2648057 1.00 SMN1; SMN2 (0.47) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2665118 1.00 SMN1; SMN2 (0.47) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2664958 0.97 GCGR (0.45) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2649603 0.97 GCGR (0.45) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2649608 0.97 GCGR (0.45) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2647338 0.97 GCGR (0.45) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2647340 0.97 GCGR (0.45) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2648373 0.95 CYP2D6 (0.44) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2647075 0.95 CYP2D6 (0.44) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3
SCHEMBL2648378 0.95 CYP2D6 (0.44) SMN1; SMN2CYP2D6GCGRTAOK1TAOK3

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
EP-1463715-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2004-10-06 EP disclosed
US-6762318-B2 CARBOXYLIC ACID OR TETRAZOLE DERIVATIZED SECONDARY AMIDES; ORAL ADMINISTRATION NOVO NORDISK A/S (DK) 2004-07-13 US disclosed
US-20030236292-A1 Stimulant releasing glucose from liver cells; antidiabetic agents PFIZER INC 2003-12-25 US disclosed
WO-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 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-20030236292-A1 Stimulant releasing glucose from liver cells; antidiabetic agents GPR119, GLP1R, GIPR SMN1; SMN2 4245/4885CYP2D6 2704/4885GCGR 4/4885

“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.