SCHEMBL2394762

SCHEMBL2394762

O=C(O)c1cccc2nc(C(F)(F)C(F)(F)F)[nH]c12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
HPGD P15428 1/20 0.47
KEAP1 Q14145 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 1/20 0.38
PKM P14618 1/20 0.38
DHODH Q02127 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM5B Q9UGL1 5/20 0.37
KDM5A P29375 4/20 0.37
KDM4C Q9H3R0 4/20 0.37
KDM4A O75164 1/20 0.37
PARP1 P09874 1/20 0.37
ELANE P08246 1/20 0.36
PBRM1 Q86U86 1/20 0.36
GFER P55789 2/20 0.35
MAPT P10636 1/20 0.35
PIM1 P11309 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.35

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
SCHEMBL2399383 0.88 KDM4E (0.60) KDM4EHPGDKEAP1ALDH1A1RAB9A
SCHEMBL2397310 0.83 KDM4E (0.42) KDM4EHPGDALDH1A1SMN1; SMN2KDM5A
SCHEMBL4728675 0.82 KDM5B (0.43) KDM4EHPGDKEAP1ALDH1A1RAB9A
SCHEMBL2394770 0.79 ELANE (0.37) KDM4EHPGDALDH1A1PKMSMN1; SMN2
SCHEMBL29893950 0.76 ALDH1A1 (0.47) KDM4EHPGDKEAP1ALDH1A1RAB9A
SCHEMBL7321877 0.75 PARP1 (0.61) KDM4EHPGDALDH1A1PKMSMN1; SMN2
SCHEMBL8952892 0.74 ALDH1A1 (0.47) KDM4EHPGDKEAP1ALDH1A1RAB9A
SCHEMBL7863162 0.74 ALDH1A1 (0.47) KDM4EHPGDKEAP1ALDH1A1RAB9A
SCHEMBL18758064 0.74 ALDH1A1 (0.47) KDM4EHPGDKEAP1ALDH1A1RAB9A
SCHEMBL4244593 0.73 ALDH1A1 (0.46) KDM4EHPGDKEAP1ALDH1A1RAB9A

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-2542533-B1 FLUORALKYL-SUBSTITUTED 2-AMIDOBENZIMIDAZOLES AND THEIR USE FOR INCREASING STRESS TOLERANCE IN PLANTS BAYER IP GMBH (DE) 2014-09-10 EP disclosed
EP-2561759-A1 Fluoroalkyl-substituted 2-amidobenzimidazoles and their effect on plant growth Bayer Cropscience AG (DE) 2013-02-27 EP disclosed
EP-2542533-A1 FLUOROALKYL-SUBSTITUTED 2-AMIDOBENZIMIDAZOLES AND THE USE THEREOF FOR BOOSTING STRESS TOLERANCE IN PLANTS Bayer Intellectual Property GmbH (DE) 2013-01-09 EP disclosed
WO-2011107504-A1 FLUOROALKYL-SUBSTITUTED 2-AMIDOBENZIMIDAZOLES AND THE USE THEREOF FOR BOOSTING STRESS TOLERANCE IN PLANTS BAYER CROPSCIENCE AG (DE) 2011-09-09 WO disclosed
US-20110218103-A1 Fluoroalkyl-substituted 2-amidobenzimidazoles BAYER CROPSCIENCE AG (DE) 2011-09-08 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-20110218103-A1 Fluoroalkyl-substituted 2-amidobenzimidazoles BOLA2; BOLA2B, ARFIP2, PFAS KDM4E 2009/4885HPGD 3714/4885KEAP1 126/4885

“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.