SCHEMBL6723778

SCHEMBL6723778

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.38
KDM4E B2RXH2 2/20 0.38
HTT P42858 1/20 0.38
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
CYP1A2 P05177 2/20 0.37
KDR P35968 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
F2 P00734 1/20 0.36
TOP1 P11387 1/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
NPC1 O15118 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
SCHEMBL6830098 0.84 F10 (0.43) F10ALOX5APFEN1F2TOP1
SCHEMBL6724296 0.84 F10 (0.50) F10SMN1; SMN2KDM4EHTTCYP1A2
SCHEMBL6723781 0.84 S1PR1 (0.42) F10F2TOP1TRPV1CNR1
SCHEMBL6727060 0.81 F10 (0.40) F10SMN1; SMN2KDM4EHTTF2
SCHEMBL6727231 0.79 ADORA2A (0.36) F10SMN1; SMN2KDM4EHTTKMT2A
SCHEMBL6719360 0.78 F10 (0.61) F10SMN1; SMN2KDM4EHTTMEN1
SCHEMBL6836689 0.78 MEN1 (0.38) SMN1; SMN2KDM4EHTTALOX5APFEN1
SCHEMBL6724301 0.77 S1PR1 (0.41) SMN1; SMN2KDM4EHTTMEN1KMT2A
SCHEMBL6727095 0.76 F10 (0.58) F10SMN1; SMN2KDM4EHTTF2
SCHEMBL6726983 0.74 F10 (0.48) F10SMN1; SMN2KDM4EHTTF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6673745-B2 Herbicidal 3,5-difluoropyridines BASF AKTIENGESELLSCHAFT (DE) 2004-01-06 US claimed
EP-0887343-B1 Herbicidal 3,5-difluoropyridines BASF AG (DE) 2003-06-11 EP claimed
US-20010011064-A1 Herbicidal 3,5-difluoropyridines AMERICAN CYANAMID COMPANY (US) 2001-08-02 US claimed
EP-0887343-A1 Herbicidal 3,5-difluoropyridines American Cyanamid Company (US) 1998-12-30 EP claimed
US-6673745-B2 Herbicidal 3,5-difluoropyridines BASF AKTIENGESELLSCHAFT (DE) 2004-01-06 US disclosed
EP-0887343-B1 Herbicidal 3,5-difluoropyridines BASF AG (DE) 2003-06-11 EP 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
EP-0887343-A1 Herbicidal 3,5-difluoropyridines American Cyanamid Company (US) 1998-12-30 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-20010011064-A1 Herbicidal 3,5-difluoropyridines DDT, CYP1B1, NQO2 F10 4430/4885SMN1; SMN2 2856/4885KDM4E 1341/4885

“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.