SCHEMBL363185

SCHEMBL363185

Cc1ccccc1[C@H](CC(=O)c1ccnc(Cl)c1)c1ccc(-c2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPBAR1 Q8TDU6 3/20 0.63
CTSA P10619 7/20 0.40
NR3C2 P08235 1/20 0.39
KMO O15229 1/20 0.39
MGAM O43451 4/20 0.38
GAA P10253 4/20 0.38
SI P14410 4/20 0.38
MGAM2 Q2M2H8 4/20 0.38
LOXL2 Q9Y4K0 1/20 0.36
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36

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
SCHEMBL363310 0.89 GPBAR1 (0.78) GPBAR1CTSANR3C2MGAMGAA
SCHEMBL362812 0.89 GPBAR1 (0.78) GPBAR1CTSANR3C2MGAMGAA
SCHEMBL365538 0.89 GPBAR1 (0.78) GPBAR1CTSANR3C2MGAMGAA
SCHEMBL364172 0.88 GPBAR1 (0.56) GPBAR1CTSAMGAMGAASI
SCHEMBL1390286 0.88 GPBAR1 (0.56) GPBAR1CTSAMGAMGAASI
SCHEMBL1390162 0.88 GPBAR1 (0.82) GPBAR1CTSANR3C2KMOLOXL2
SCHEMBL1390161 0.88 GPBAR1 (0.82) GPBAR1CTSANR3C2KMOLOXL2
SCHEMBL365154 0.88 GPBAR1 (0.82) GPBAR1CTSANR3C2KMOLOXL2
SCHEMBL1390160 0.88 GPBAR1 (0.82) GPBAR1CTSANR3C2KMOLOXL2
SCHEMBL1390405 0.87 GPBAR1 (0.48) GPBAR1CTSANR3C2MGAMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2593426-B1 1-HYDROXYIMINO-3-PHENYL-PROPANES HOFFMANN LA ROCHE (CH) 2014-08-20 EP disclosed
US-8765730-B2 1-hydroxyimino-3-phenyl-propanes Hoffmann-La Roche Inc (US) 2014-07-01 US disclosed
EP-2593426-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F.HOFFMANN-LA ROCHE AG (CH) 2013-05-22 EP disclosed
WO-2012007365-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-19 WO disclosed
US-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES F. HOFFMANN-LA ROCHE AG (CH) 2012-01-12 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 (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-20120010190-A1 1-HYDROXYIMINO-3-PHENYL-PROPANES GPBAR1, GPR119, ADRB1 GPBAR1 1/4885CTSA 3225/4885NR3C2 232/4885

“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.