SCHEMBL370636

SCHEMBL370636

COC(=O)c1cccc(Oc2ccc(C(CC(=O)c3ccc(=O)n(C)c3)c3ccc(Cl)cc3C)cc2F)c1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 8/20 0.37
PTGER4 P35408 2/20 0.37
PTGER2 P43116 1/20 0.37
P2RX3 P56373 3/20 0.35
MRGPRX4 Q96LA9 2/20 0.35
KEAP1 Q14145 1/20 0.34
NFE2L2 Q16236 1/20 0.34
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL370348 0.93 MRGPRX4 (0.42) BRD4PTGER4PTGER2P2RX3MRGPRX4
SCHEMBL368801 0.89 P2RX3 (0.42) P2RX3LMNAL3MBTL1
SCHEMBL370635 0.88 BRD4 (0.40) BRD4
SCHEMBL371041 0.85 FFAR1 (0.37) BRD4PTGER4PTGER2
SCHEMBL362920 0.85 MRGPRX4 (0.40) BRD4PTGER4PTGER2P2RX3MRGPRX4
SCHEMBL362921 0.85 MRGPRX4 (0.40) BRD4PTGER4PTGER2P2RX3MRGPRX4
SCHEMBL369921 0.84 BAZ2B (0.36) BRD4PTGER4PTGER2P2RX3L3MBTL1
SCHEMBL1390419 0.83 LMNA (0.43) KEAP1NFE2L2LMNAL3MBTL1
SCHEMBL369104 0.83 PPARG (0.38) P2RX3
SCHEMBL369275 0.82 P2RX3 (0.39) PTGER4PTGER2P2RX3LMNAL3MBTL1

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 BRD4 3540/4885PTGER4 103/4885PTGER2 47/4885

“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.