SCHEMBL363719

SCHEMBL363719

COc1ccc(/C=C/C(=O)c2ccc(F)cc2Cl)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
PADI4 Q9UM07 1/20 0.52
MAOB P27338 3/20 0.50
KMT2A Q03164 1/20 0.50
MAOA P21397 1/20 0.50
CXCL12 P48061 3/20 0.48
CTSL P07711 2/20 0.48
GAA P10253 2/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
ACHE P22303 1/20 0.43
BACE1 P56817 1/20 0.43
ABCG2 Q9UNQ0 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
MCL1 Q07820 1/20 0.43
TUBB4A P04350 1/20 0.42

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
SCHEMBL364403 0.84 SMN1; SMN2 (0.50) LMNASMN1; SMN2NPC1RAB9APADI4
SCHEMBL363978 0.84 CXCL12 (0.64) LMNASMN1; SMN2NPC1RAB9APADI4
SCHEMBL363641 0.83 CXCL12 (0.59) LMNASMN1; SMN2NPC1RAB9APADI4
SCHEMBL4258491 0.81 NPC1 (0.42) LMNASMN1; SMN2NPC1RAB9APADI4
SCHEMBL364142 0.80 LMNA (0.50) LMNASMN1; SMN2NPC1RAB9APADI4
SCHEMBL363768 0.80 LMNA (0.63) LMNASMN1; SMN2MAOBKMT2ACTSL
SCHEMBL363188 0.80 MAOB (0.60) MAOBKMT2AMAOACXCL12ABCG2
SCHEMBL4258496 0.80 SMN1; SMN2 (0.43) LMNASMN1; SMN2NPC1RAB9APADI4
SCHEMBL4258490 0.80 SMN1; SMN2 (0.43) LMNASMN1; SMN2NPC1RAB9APADI4
SCHEMBL364871 0.79 MEN1 (0.47) LMNASMN1; SMN2NPC1RAB9APADI4

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 LMNA 2651/4885SMN1; SMN2 2264/4885NPC1 1074/4885

“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.