SCHEMBL7062432

SCHEMBL7062432

COc1ccc(-c2ccc(C(F)(F)C=CC(=O)OCc3ccccc3)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.47
LMNA P02545 2/20 0.45
NPC1 O15118 3/20 0.43
RAB9A P51151 2/20 0.43
ATM Q13315 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA12 O43570 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
CA5B Q9Y2D0 2/20 0.43
MAPT P10636 2/20 0.43
AKR1B10 O60218 1/20 0.42
AKR1B1 P15121 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MGLL Q99685 1/20 0.42
MAOB P27338 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
SCHEMBL7062429 1.00 HCAR2 (0.47) HCAR2LMNANPC1RAB9AATM
SCHEMBL6450384 0.84 MLYCD (0.43) NPC1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL6450381 0.84 MLYCD (0.43) NPC1RAB9AL3MBTL1MAPTALDH1A1
SCHEMBL6462008 0.78 MAOB (0.41) LMNAMAPTALDH1A1MAOB
SCHEMBL26342112 0.77 HCAR2 (0.63) HCAR2LMNAL3MBTL1CA12CA4
SCHEMBL4965299 0.75 HCAR2 (0.65) HCAR2LMNAL3MBTL1CA12CA4
SCHEMBL26340997 0.75 HCAR2 (0.65) HCAR2LMNAL3MBTL1CA12CA4
SCHEMBL26341007 0.75 HCAR2 (0.65) HCAR2LMNAL3MBTL1CA12CA4
SCHEMBL839208 0.75 LMNA (0.75) HCAR2LMNAATMCA12CA4
SCHEMBL17603656 0.75 LMNA (0.75) HCAR2LMNAATMCA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030139453-A1 Difluorobutyric acid metalloprotease inhibitors THE PROCTER & GAMBLE COMPANY 2003-07-24 US disclosed
EP-1265865-A2 DIFLUOROBUTYRIC ACID DERIVATIVES AND THEIR USE AS METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2002-12-18 EP disclosed
WO-2001070693-A2 DIFLUOROBUTYRIC ACID DERIVATIVES AND THEIR USE AS METALLOPROTEASE INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2001-09-27 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-20030139453-A1 Difluorobutyric acid metalloprotease inhibitors DPEP1, TMPRSS15, FAP HCAR2 635/4885LMNA 4239/4885NPC1 1376/4885

“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.