SCHEMBL3075356

SCHEMBL3075356

Nc1ccccc1OC(F)(F)C(F)Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
ADRA2B P18089 1/20 0.41
PTGS1 P23219 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 1/20 0.34
GAA P10253 2/20 0.33
RCE1 Q9Y256 1/20 0.33
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL418646 0.86 ALDH1A1 (0.45) ALDH1A1ADRA2BPTGS1TDP1KDM4E
SCHEMBL7751646 0.86 LMNA (0.42) ALDH1A1LMNAPOLBTSHR
SCHEMBL2940314 0.81 ALDH1A1 (0.41) ALDH1A1ADRA2BPTGS1TDP1KDM4E
SCHEMBL9502593 0.81 ALDH1A1 (0.38) ALDH1A1KDM4EMAPTCRHBPCRHR2
SCHEMBL7750622 0.79 LMNA (0.38) ALDH1A1PTGS1MAPTLMNAPOLB
SCHEMBL7753023 0.79 LMNA (0.34) ALDH1A1KDM4EMAPTLMNAPOLB
SCHEMBL27805477 0.78 CA2 (0.41) ALDH1A1TDP1KDM4EMAPTLMNA
SCHEMBL9807512 0.78 LMNA (0.40) ALDH1A1KDM4ELMNAPOLBCYP1A2
SCHEMBL15391806 0.76 ALDH1A1 (0.46) ALDH1A1ADRA2BPTGS1TDP1KDM4E
SCHEMBL112134 0.76 ALDH1A1 (0.50) ALDH1A1ADRA2BPTGS1TDP1KDM4E

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-20100222217-A1 Fungicidal N-[2-(Haloalkoxy)Phenyl]Heteroarylcarboxamides BASF AKTIENGESELLSCHAFT (DE) 2010-09-02 US disclosed
EP-1912497-A1 FUNGICIDAL N-[2-(HALOALKOXY)PHENYL]HETEROARYLCARBOXAMIDES BASF SE (DE) 2008-04-23 EP disclosed
WO-2007017450-A1 FUNGICIDAL N-[2-(HALOALKOXY)PHENYL]HETEROARYLCARBOXAMIDES BASF SE (DE) 2007-02-15 WO disclosed
EP-0337600-A2 Benzoylurea derivative, process for producing the same, insecticide containing the same, reaction intermediate of the same and process for producing the intermediate SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-10-18 EP disclosed
EP-0318782-A2 Substituted benzoyl(thio) ureas BAYER AG (DE) 1989-06-07 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-20100222217-A1 Fungicidal N-[2-(Haloalkoxy)Phenyl]Heteroarylcarboxamides CBR3, HDHD5, CYP8B1 ALDH1A1 1188/4885ADRA2B 2818/4885PTGS1 2278/4885

“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.