SCHEMBL1193448

SCHEMBL1193448

O=C(C=NO)c1ccc(F)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
TNFRSF1A P19438 1/20 0.52
MAPT P10636 3/20 0.50
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
BCL2L1 Q07817 1/20 0.43
BAD Q92934 1/20 0.43
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.43
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
CYP1A1 P04798 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
SCHEMBL12997454 1.00 MEN1 (0.53) MEN1KMT2ATNFRSF1AMAPTCES2
SCHEMBL11490236 1.00 MEN1 (0.53) MEN1KMT2ATNFRSF1AMAPTCES2
Propene SCHEMBL3798192 0.91 MAPT (0.47) MEN1KMT2ATNFRSF1AMAPTCES2
Fluorobenzene SCHEMBL28122683 0.86 ALDH1A1 (0.47) MEN1KMT2ATNFRSF1AMAPTCES2
Fluorobenzene SCHEMBL28285720 0.86 ALDH1A1 (0.47) MEN1KMT2ATNFRSF1AMAPTCES2
SCHEMBL9056522 0.80 ALDH5A1 (0.56) MEN1KMT2AMAPTCES2CA1
SCHEMBL4452292 0.80 ALDH5A1 (0.56) MEN1KMT2AMAPTCES2CA1
SCHEMBL8420807 0.78 CES2 (0.50) MAPTCES2CES1CYP1A2CYP2C19
SCHEMBL5469788 0.78 CES2 (0.50) MAPTCES2CES1CYP1A2CYP2C19
SCHEMBL4862884 0.78 CES2 (0.50) MEN1KMT2AMAPTCES2CES1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113527138-B Para-fluorobenzoyl oxime ester photoinitiator for preparing photochromic material as well as preparation method and application thereof 北京化工大学 2023-06-13 CN claimed
CN-113527138-A P-fluorobenzoyl oxime ester photoinitiator for preparing photochromic material and preparation method and application thereof 北京化工大学 2021-10-22 CN claimed
CN-113527138-B Para-fluorobenzoyl oxime ester photoinitiator for preparing photochromic material as well as preparation method and application thereof 北京化工大学 2023-06-13 CN disclosed
CN-113527138-A P-fluorobenzoyl oxime ester photoinitiator for preparing photochromic material and preparation method and application thereof 北京化工大学 2021-10-22 CN disclosed
US-20110034514-A1 5-Lipoxygenase-Activating Protein (FLAP) Inhibitors AMIRA PHARMACEUTICALS, INC. (US) 2011-02-10 US disclosed
US-7834037-B2 1,3,5-Substituted indole derivatives, e.g., 3-[3-tert-butylthio-1-[4-(6-methoxypyridin-3-yl)-benzyl]-5-(pyridin-2-ylmethoxy)-indol-2-yl]-2,2-dimethyl-propionic acid; used alone and in combination with other compounds for treating leukotriene-dependent diseases such as respiratory and cardiovascular AMIRA PHARMACEUTICALS, INC. (US) 2010-11-16 US disclosed
US-20090018170-A1 1,3,5-Substituted indole derivatives, e.g., 3-[3-tert-butylthio-1-[4-(6-methoxypyridin-3-yl)-benzyl]-5-(pyridin-2-ylmethoxy)-indol-2-yl]-2,2-dimethyl-propionic acid; used alone and in combination with other compounds for treating leukotriene-dependent diseases such as respiratory and cardiovascular AMIRA PHARMACEUTICALS, INC. (US) 2009-01-15 US disclosed
US-20070225285-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2007-09-27 US disclosed
EP-1673092-B1 HETEROCYCLE-SUBSTITUTED PTERIDINE DERIVATIVES AND THEIR USE IN THERAPY 4 AZA IP NV (BE) 2007-08-15 EP disclosed
US-20070032477-A1 Pteridine derivatives useful for making pharmaceutical compositions 4 AZA BIOSCIENCE NV (BE) 2007-02-08 US disclosed
EP-1673092-A1 HETEROCYCLE-SUBSTITUTED PTERIDINE DERIVATIVES AND THEIR USE IN THERAPY 4 AZA Bioscience nv (BE) 2006-06-28 EP disclosed
WO-2005039587-A1 HETEROCYCLE-SUBSTITUTED PTERIDINE DERIVATIVES AND THEIR USE IN THERAPY 4 AZA BIOSCIENCE NV (BE) 2005-05-06 WO disclosed
US-4229579-A OPTICAL BRIGHTENERS BAYER AKTIENGESELLSCHAFT (DE) 1980-10-21 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 (4 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-20070225285-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 MEN1 4629/4885KMT2A 4230/4885TNFRSF1A 1175/4885
US-20090018170-A1 1,3,5-Substituted indole derivatives, e.g., 3-[3-tert-butylthio-1-[4-(6-methoxypyridin-3-yl)-benzyl]-5-(pyridin-2-ylmethoxy)-indol-2-yl]-2,2-dimethyl-propionic acid; used alone and in combination with other compounds for treating leukotriene-dependent diseases such as respiratory and cardiovascular LTC4S, ALOX5, LTA4H MEN1 4241/4885KMT2A 2935/4885TNFRSF1A 1646/4885
US-20110034514-A1 5-Lipoxygenase-Activating Protein (FLAP) Inhibitors ALOX5, ALOX15B, ALOX15 MEN1 4629/4885KMT2A 4230/4885TNFRSF1A 1175/4885
US-20070032477-A1 Pteridine derivatives useful for making pharmaceutical compositions TPMT, TYMS, TNF MEN1 3052/4885KMT2A 2688/4885TNFRSF1A 44/4885

“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.