SCHEMBL6836689

SCHEMBL6836689

N#Cc1c(F)c(Oc2ccnc(C(F)(F)F)c2)nc(-c2ccc(C(F)(F)F)cc2)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
CYP1A2 P05177 2/20 0.38
KDM4E B2RXH2 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
ALOX5AP P20292 3/20 0.37
FEN1 P39748 2/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HTT P42858 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
SCHEMBL6724301 0.88 S1PR1 (0.41) MEN1KMT2ANPSR1CYP1A2KDM4E
SCHEMBL6830098 0.84 F10 (0.43) ALOX5APFEN1
SCHEMBL6727035 0.83 KDM4E (0.49) NPSR1CYP1A2KDM4ESMN1; SMN2ALDH1A1
SCHEMBL6723778 0.78 F10 (0.42) MEN1KMT2ANPSR1CYP1A2KDM4E
SCHEMBL6722869 0.76 KDM4E (0.47) NPSR1CYP1A2KDM4ESMN1; SMN2ALDH1A1
SCHEMBL6723781 0.72 S1PR1 (0.42) CNR1
SCHEMBL6727060 0.72 F10 (0.40) KDM4ESMN1; SMN2NPC1RAB9AHTT
SCHEMBL6724296 0.70 F10 (0.50) CYP1A2KDM4ESMN1; SMN2CYP2C9CYP2C19
SCHEMBL5217466 0.69 TGFBR1 (0.40) KDM4ECYP3A4ALOX5APFEN1LMNA
SCHEMBL27894825 0.68 LOXL2 (0.50) CYP3A4ALOX5APFEN1CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010011064-A1 Herbicidal 3,5-difluoropyridines AMERICAN CYANAMID COMPANY (US) 2001-08-02 US claimed
US-6673745-B2 Herbicidal 3,5-difluoropyridines BASF AKTIENGESELLSCHAFT (DE) 2004-01-06 US disclosed
US-6310006-B1 CONTROLLING WEEDS AMERICAN CYANAMID COMPANY 2001-10-30 US disclosed
US-20010011064-A1 Herbicidal 3,5-difluoropyridines AMERICAN CYANAMID COMPANY (US) 2001-08-02 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-20010011064-A1 Herbicidal 3,5-difluoropyridines DDT, CYP1B1, NQO2 MEN1 4524/4885KMT2A 994/4885NPSR1 3079/4885

“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.