SCHEMBL369509

SCHEMBL369509

Cc1cc(Cl)ccc1C(CC(=O)c1ccc(=O)n(C(=O)CC(c2ccc(Br)cc2)c2ccc(Cl)cc2C)c1)c1ccc(Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.45
POLB P06746 2/20 0.38
GPBAR1 Q8TDU6 1/20 0.37
MGAM O43451 3/20 0.36
GAA P10253 3/20 0.36
SI P14410 3/20 0.36
MGAM2 Q2M2H8 3/20 0.36
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
PRKCZ Q05513 1/20 0.33
CACNA1G O43497 1/20 0.32
PTGFR P43088 1/20 0.32

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
SCHEMBL371141 0.88 GPBAR1 (0.37) KMT2AGPBAR1MGAMGAASI
SCHEMBL368816 0.88 KMT2A (0.46) KMT2APOLBGPBAR1MGAMGAA
SCHEMBL368765 0.88 ADORA3 (0.37) POLBGPBAR1MGAMGAASI
SCHEMBL369581 0.80 POLB (0.40) KMT2APOLBGPBAR1MGAMGAA
SCHEMBL363436 0.79 KMT2A (0.47) KMT2APOLBGPBAR1CYP2C9CYP2C19
SCHEMBL369868 0.79 KMT2A (0.47) KMT2APOLBMGAMGAASI
SCHEMBL371309 0.79 POLB (0.40) KMT2APOLBMGAMGAASI
SCHEMBL15832896 0.78 POLB (0.39) KMT2APOLBMGAMGAASI
SCHEMBL369750 0.78 POLB (0.40) KMT2APOLBMGAMGAASI
SCHEMBL370765 0.77 CYP2C9 (0.39) KMT2APOLBMGAMGAASI

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 KMT2A 3981/4885POLB 2940/4885GPBAR1 1/4885

“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.