SCHEMBL10076388

SCHEMBL10076388

Fc1ccc(C2CCNC[C@H]2CCc2ccc3c(c2)OCO3)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.66
SLC6A4 P31645 3/20 0.66
GRK2 P25098 3/20 0.66
TP53 P04637 2/20 0.66
CYP1A2 P05177 2/20 0.66
CYP2D6 P10635 2/20 0.66
ALDH1A1 P00352 1/20 0.66
CYP2C9 P11712 1/20 0.66
HSD17B10 Q99714 1/20 0.66
NPC1 O15118 1/20 0.66
CACNA1F O60840 1/20 0.66
MPO P05164 1/20 0.66
ADRB2 P07550 1/20 0.66
CHRM2 P08172 1/20 0.66
CHRM4 P08173 1/20 0.66
ABCB1 P08183 1/20 0.66
HTR1A P08908 1/20 0.66
CHRM5 P08912 1/20 0.66
ADORA3 P0DMS8 1/20 0.66
CHRM1 P11229 1/20 0.66

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
SCHEMBL13242436 1.00 CYP3A4 (0.66) CYP3A4SLC6A4GRK2TP53CYP1A2
Hydrochloric Acid SCHEMBL25272655 0.99 CYP3A4 (0.66) CYP3A4SLC6A4GRK2TP53CYP1A2
SCHEMBL6041369 0.80 REN (0.50) CYP3A4SLC6A4GRK2TP53CYP1A2
Paroxetine SCHEMBL15855060 0.79 CYP3A4 (1.00) CYP3A4SLC6A4GRK2TP53CYP1A2
Paroxetine SCHEMBL1945816 0.79 CYP3A4 (1.00) CYP3A4SLC6A4GRK2TP53CYP1A2
Paroxetine SCHEMBL8732632 0.79 CYP3A4 (1.00) CYP3A4SLC6A4GRK2TP53CYP1A2
Paroxetine SCHEMBL1286957 0.79 CYP3A4 (1.00) CYP3A4SLC6A4GRK2TP53CYP1A2
Paroxetine SCHEMBL10643985 0.79 CYP3A4 (1.00) CYP3A4SLC6A4GRK2TP53CYP1A2
Paroxetine SCHEMBL27799 0.79 CYP3A4 (1.00) CYP3A4SLC6A4GRK2TP53CYP1A2
Paroxetine SCHEMBL1560678 0.79 CYP3A4 (1.00) CYP3A4SLC6A4GRK2TP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3281628-B1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS NALPROPION PHARMACEUTICALS INC (US) 2019-09-11 EP disclosed
US-20120010232-A1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS OREXIGEN THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-20100190793-A1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS OREXIGEN THERAPEUTICS, INC. (US) 2010-07-29 US disclosed
US-7462626-B2 Compositions for affecting weight loss OREXIGEN THERAPEUTICS, INC. (US) 2008-12-09 US disclosed
US-7375111-B2 Compositions for affecting weight loss OREXIGEN THERAPEUTICS, INC. (US) 2008-05-20 US disclosed
EP-1617832-B1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS OREXIGEN THERAPEUTICS INC (US) 2008-03-12 EP disclosed
US-20070270450-A1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS OREXIGEN THERAPEUTICS, INC. (US) 2007-11-22 US 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 (3 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-20100190793-A1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS MC4R, MC3R, MC5R CYP3A4 3921/4885SLC6A4 978/4885GRK2 100/4885
US-20120010232-A1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS MC4R, MC3R, MC5R CYP3A4 3921/4885SLC6A4 978/4885GRK2 100/4885
US-20070270450-A1 COMPOSITIONS FOR AFFECTING WEIGHT LOSS MC4R, MC3R, MC5R CYP3A4 3921/4885SLC6A4 978/4885GRK2 100/4885

“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.