SCHEMBL369536

SCHEMBL369536

Cn1cc(C(=O)CC(c2ccc(C(=O)O)cc2)c2ccc(Cl)cc2F)ccc1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.38
CREBBP Q92793 1/20 0.37
F11 P03951 3/20 0.37
MDM2 Q00987 1/20 0.36
CYP2C9 P11712 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
CYP2C19 P33261 1/20 0.36
MGAM O43451 2/20 0.36
GAA P10253 2/20 0.36
SI P14410 2/20 0.36
MGAM2 Q2M2H8 2/20 0.36
KLKB1 P03952 1/20 0.35
PHGDH O43175 1/20 0.35
S1PR3 Q99500 3/20 0.35
S1PR1 P21453 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL1390467 0.93 POLB (0.37) POLBMDM2CYP2C9KMT2AMEN1
SCHEMBL371366 0.92 KMT2A (0.46) POLBMDM2CYP2C9KMT2ACYP2C19
SCHEMBL369928 0.91 CYP2C9 (0.39) POLBMDM2CYP2C9KMT2ACYP2C19
SCHEMBL370670 0.90 CREBBP (0.43) POLBCREBBPMDM2CYP2C9KMT2A
SCHEMBL370027 0.89 EPHX2 (0.37) POLBS1PR3S1PR1
SCHEMBL369581 0.88 POLB (0.40) POLBCREBBPF11CYP2C9KMT2A
SCHEMBL369115 0.88 PTGDR2 (0.36) POLBMDM2CYP2C9CYP2C19MGAM
SCHEMBL368098 0.87 GCG (0.39) POLBMDM2S1PR3S1PR1
SCHEMBL368688 0.87 S1PR3 (0.39) POLBMDM2KMT2AMEN1S1PR3
SCHEMBL370021 0.86 GPBAR1 (0.44) CREBBPF11MDM2KLKB1PHGDH

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 POLB 2940/4885CREBBP 2198/4885F11 2380/4885

“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.