SCHEMBL1390372

SCHEMBL1390372

COc1ccc(C(=O)C=Cc2ccc(C)cc2F)cn1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.54
MAOA P21397 2/20 0.54
KLKB1 P03952 1/20 0.46
EGFR P00533 1/20 0.45
NNMT P40261 1/20 0.45
CYP1A1 P04798 2/20 0.44
CYP1B1 Q16678 2/20 0.44
CTSL P07711 2/20 0.44
CTSB P07858 2/20 0.44
NPC1 O15118 1/20 0.42
LMNA P02545 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
TNFRSF1A P19438 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL1390301 0.88 MAOB (0.55) MAOBMAOAEGFRCYP1A1CYP1B1
SCHEMBL1390298 0.87 MAOB (0.65) MAOBMAOAEGFRNNMTCYP1A1
SCHEMBL1390730 0.87 MAOB (0.65) MAOBMAOAEGFRNNMTCYP1A1
SCHEMBL1390232 0.87 MAOB (0.53) MAOBMAOANNMTCYP1A1CYP1B1
SCHEMBL1390340 0.84 MAOB (0.66) MAOBMAOANNMTCYP1A1CYP1B1
SCHEMBL1390666 0.80 MAOB (0.58) MAOBMAOANNMTCYP1A1CYP1B1
SCHEMBL1390294 0.79 MAOB (0.66) MAOBMAOAEGFRNNMTNPC1
SCHEMBL1390413 0.78 MAOA (0.51) MAOBMAOANNMTCYP1A1CYP1B1
SCHEMBL369664 0.78 MAOA (0.65) MAOBMAOANNMTCYP1A1CYP1B1
SCHEMBL369665 0.78 MAOA (0.65) MAOBMAOANNMTCYP1A1CYP1B1

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 MAOB 1814/4885MAOA 2715/4885KLKB1 3220/4885

“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.