SCHEMBL1338732

SCHEMBL1338732

CCN(CC)C(F)(F)c1c(C)cc(C)cc1C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
RAPGEF4 Q8WZA2 2/20 0.32

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
SCHEMBL28228647 0.69 RAPGEF4 (0.39) MEN1LMNAKMT2ARAPGEF4
SCHEMBL10994353 0.69 RAPGEF4 (0.43) MEN1LMNAKMT2ASMN1; SMN2RAPGEF4
SCHEMBL812665 0.68 TSHR (0.41)
SCHEMBL10063564 0.67 RAPGEF4 (0.33) RAPGEF4
SCHEMBL295495 0.65 ACHE (0.35) MEN1LMNAKMT2A
SCHEMBL17943451 0.64 RAPGEF4 (0.35) LMNASMN1; SMN2RAPGEF4
SCHEMBL2360359 0.62 CRHR1 (0.46) HPGDMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL1367414 0.62 CRHR1 (0.42) HPGDMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL15420053 0.62 RIPK1 (0.33) MEN1KMT2A
SCHEMBL13550107 0.62 RAPGEF4 (0.40) MEN1LMNAKMT2ASMN1; SMN2RAPGEF4

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
US-8063205-B2 Method for producing 2-oxazoline analogue or 1,3-oxazine analogue NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2011-11-22 US disclosed
US-20090281309-A1 METHOD FOR PRODUCING 2-OXAZOLINE ANALOGUE OR 1,3-OXAZINE ANALOGUE NATIONAL UNIVERSITY CORPORATION HOKKAIDO UNIVERSITY (JP) 2009-11-12 US disclosed
EP-1956012-A1 METHOD FOR PRODUCING 2-OXAZOLINE ANALOGUE OR 1,3-OXAZINE ANALOGUE National University Corporation Hokkaido University (JP) 2008-08-13 EP 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-20090281309-A1 METHOD FOR PRODUCING 2-OXAZOLINE ANALOGUE OR 1,3-OXAZINE ANALOGUE OXA1L, SULT1A1, DAO HPGD 2260/4885MEN1 4342/4885LMNA 4507/4885

“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.