SCHEMBL1390282

SCHEMBL1390282

COc1ccc(CC(=O)C(c2ccccc2C)c2ccc(Br)cc2F)cn1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.36
CTSA P10619 3/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
NPC1 O15118 2/20 0.35
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
GPR183 P32249 1/20 0.34
NAMPT P43490 1/20 0.34
FFAR1 O14842 2/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
CRHR1 P34998 1/20 0.33
TAS2R14 Q9NYV8 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 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
SCHEMBL15949088 0.89 CTSA (0.39) METCTSAKMT2AMEN1NPC1
SCHEMBL368592 0.82 HDAC4 (0.43) KMT2AMEN1NPC1LMNAPKM
SCHEMBL1390211 0.80 OXTR (0.37) METKMT2AMEN1NPC1LMNA
SCHEMBL370462 0.79 SMO (0.36) METKMT2AMEN1NPC1LMNA
SCHEMBL1390492 0.79 RECQL (0.38) METKMT2AMEN1NPC1PKM
SCHEMBL1390216 0.77 CTSA (0.41) CTSAGPR183POLB
SCHEMBL1390360 0.77 GPR183 (0.38) GPR183
SCHEMBL1390254 0.76 RECQL (0.39) METKMT2AMEN1NPC1LMNA
SCHEMBL369863 0.74 SMN1; SMN2 (0.40) CTSAKMT2AMEN1NPC1LMNA
SCHEMBL1390335 0.69 SMN1; SMN2 (0.43) METCTSAKMT2AMEN1NPC1

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
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
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 MET 381/4885CTSA 3225/4885KMT2A 3981/4885

“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.