SCHEMBL3392497

SCHEMBL3392497

O=Cc1cccc(C(F)(F)F)c1.O=Cc1cccc(CF)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.45
POLB P06746 2/20 0.45
ALDH1A1 P00352 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NFE2L2 Q16236 1/20 0.44
ACP3 P15309 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
TTR P02766 1/20 0.43
PIM1 P11309 1/20 0.43
CISD1 Q9NZ45 1/20 0.43
PIM2 Q9P1W9 1/20 0.43
MAPT P10636 2/20 0.43
IDO1 P14902 2/20 0.42
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
HTR2B P41595 1/20 0.41
P4HB P07237 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
HSP90AA1 P07900 1/20 0.40

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
SCHEMBL3151486 0.86 MAOA (0.49) ALDH1A1
SCHEMBL67201 0.86 FBP1 (0.56) FBP1POLBALDH1A1L3MBTL1NFE2L2
SCHEMBL29425705 0.86 FBP1 (0.56) FBP1POLBALDH1A1L3MBTL1NFE2L2
SCHEMBL18001841 0.85 DAO (0.49) FBP1POLBALDH1A1L3MBTL1ACP3
SCHEMBL30644998 0.85 DAO (0.49) FBP1POLBALDH1A1L3MBTL1ACP3
SCHEMBL18002752 0.81 IDO1 (0.55) POLBALDH1A1L3MBTL1ACP3TAAR1
Acetaldehyde SCHEMBL28151033 0.81 NFE2L2 (0.54) FBP1POLBALDH1A1L3MBTL1NFE2L2
SCHEMBL3643679 0.80 TAAR1 (0.62) ALDH1A1ACP3TAAR1MAPTIDO1
SCHEMBL18002652 0.80 NFE2L2 (0.62) FBP1POLBALDH1A1L3MBTL1NFE2L2
Phenethylamine SCHEMBL7800077 0.79 TAAR1 (0.62) FBP1TAAR1IDO1HTR2AGRIN1

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
US-8318787-B2 Prodrugs of (3,5-bis(4-fluorophenyl)tetrahydro-1H-oxazolo[3,4-C]oxazol-7A-yl)methanol and derivatives thereof UNIVERSITY OF KANSAS (US) 2012-11-27 US disclosed
US-20100056592-A1 PRODRUGS OF (3,5-BIS(4-FLUOROPHENYL)TETRAHYDRO-1H-OXAZOLO[3,4-C]OXAZOL-7A-YL)METHANOL AND DERIVATIVES THEREOF UNIVERSITY OF KANSAS 2010-03-04 US disclosed
US-7598282-B2 (3R,5S,7as)-(3,5-bis(4-fluorophenyl)tetrahydro-1H-oxazolo[3,4-c]oxazol-7a-yl)methanol; does not involve microtubule stabilization; Alzheimer's UNIVERSITY OF KANSAS (US) 2009-10-06 US disclosed
WO-2007053684-A2 NEUROPROTECTIVE AGENTS UNIVERSITY OF KANSAS (US) 2007-05-10 WO disclosed
US-20070099971-A1 Neuroprotective agents UNIVERSITY OF KANSAS 2007-05-03 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 (2 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-20100056592-A1 PRODRUGS OF (3,5-BIS(4-FLUOROPHENYL)TETRAHYDRO-1H-OXAZOLO[3,4-C]OXAZOL-7A-YL)METHANOL AND DERIVATIVES THEREOF OXA1L, ADH1A, ADH1C FBP1 1703/4885POLB 546/4885ALDH1A1 10/4885
US-20070099971-A1 Neuroprotective agents MAP4, MAP1LC3A, TUBB4A FBP1 3455/4885POLB 3036/4885ALDH1A1 1371/4885

“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.