SCHEMBL368441

SCHEMBL368441

Cc1cc(C(=O)C(Cc2ccc(Br)cc2)c2ccccc2)cc(C)n1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 15/20 0.50
PTPN2 P17706 1/20 0.46
EPHX1 P07099 1/20 0.42
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
HSP90AA1 P07900 1/20 0.41
NTSR1 P30989 1/20 0.41
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39

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
SCHEMBL366143 0.82 PTPN1 (0.36) PTPN1PTPN2EPHX1MEN1NPC1
SCHEMBL368112 0.82 PTPN1 (0.36) PTPN1PTPN2EPHX1MEN1NPC1
SCHEMBL11568532 0.74 EPHX1 (0.51) PTPN1EPHX1MEN1NPC1KMT2A
SCHEMBL13305519 0.73 LMNA (0.56) PTPN1PTPN2EPHX1MEN1NPC1
SCHEMBL369940 0.72 LMNA (0.46) PTPN1PTPN2MEN1NPC1RAB9A
SCHEMBL6203944 0.72 EPHX1 (0.65) PTPN1PTPN2EPHX1RAB9A
SCHEMBL28806176 0.72 EPHX1 (0.47) EPHX1MEN1NPC1RAB9AKMT2A
SCHEMBL13305527 0.72 ALDH1A1 (0.53) MEN1NPC1RAB9AKMT2APPARG
SCHEMBL29240046 0.71 PTPN1 (0.59) PTPN1PTPN2EPHX1NPC1RAB9A
SCHEMBL370420 0.70 PTGFR (0.47) MEN1KMT2APPARGPPARA

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 6 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 claimed
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 PTPN1 1782/4885PTPN2 2373/4885EPHX1 1075/4885

“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.