SCHEMBL2646835

SCHEMBL2646835

COc1ccc(C(=O)C=Cc2ccc(OC(F)(F)F)cc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F3 P13726 2/20 0.77
MAOB P27338 10/20 0.75
CYP1B1 Q16678 3/20 0.75
CYP1A1 P04798 2/20 0.75
MAPT P10636 4/20 0.72
NPC1 O15118 1/20 0.72
LMNA P02545 1/20 0.72
MAOA P21397 4/20 0.69
XDH P47989 2/20 0.69
MEN1 O00255 2/20 0.69
ALDH1A1 P00352 2/20 0.69
KMT2A Q03164 2/20 0.69
P4HB P07237 1/20 0.69
CALM1 P0DP23 1/20 0.69
RAB9A P51151 1/20 0.69
TNFRSF1A P19438 2/20 0.67
HSPD1 P10809 1/20 0.67
HSPE1 P61604 1/20 0.67
BCHE P06276 1/20 0.67
CYP3A4 P08684 1/20 0.67

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
SCHEMBL2665209 1.00 F3 (0.77) F3MAOBCYP1B1CYP1A1MAPT
SCHEMBL2646833 1.00 F3 (0.77) F3MAOBCYP1B1CYP1A1MAPT
SCHEMBL2647392 0.93 CYP2D6 (0.63) F3MAOBCYP1B1CYP1A1MAPT
SCHEMBL2648725 0.89 MAOB (0.69) F3MAOBCYP1B1CYP1A1MAPT
SCHEMBL2648722 0.89 MAOB (0.69) F3MAOBCYP1B1CYP1A1MAPT
SCHEMBL2665078 0.89 MAOB (0.69) F3MAOBCYP1B1CYP1A1MAPT
4,4'-Dimethoxychalcone SCHEMBL978243 0.88 F3 (1.00) F3MAOBCYP1B1CYP1A1MAPT
4,4'-Dimethoxychalcone SCHEMBL978242 0.88 F3 (1.00) F3MAOBCYP1B1CYP1A1MAPT
SCHEMBL25202905 0.87 XDH (0.67) F3MAOBCYP1B1CYP1A1MAPT
SCHEMBL25196548 0.87 XDH (0.67) F3MAOBCYP1B1CYP1A1MAPT

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 F3 4692/4885MAOB 3317/4885CYP1B1 3336/4885

“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.