SCHEMBL4450127

SCHEMBL4450127

Cc1nn(C)cc1C(=O)Nc1ccccc1-c1ccc(Cl)cc1F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.57
KCNMA1 Q12791 2/20 0.47
EGFR P00533 1/20 0.47
MAPT P10636 2/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
SSTR2 P30874 1/20 0.45
NAMPT P43490 1/20 0.45
RAB9A P51151 4/20 0.44
NPC1 O15118 2/20 0.44
HPGD P15428 1/20 0.44
JAK2 O60674 3/20 0.44
JAK1 P23458 2/20 0.44
CHRM3 P20309 2/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
SCN9A Q15858 1/20 0.43

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
SCHEMBL4447437 0.90 KCNMA1 (0.46) ATMKCNMA1SMN1; SMN2RAB9ANPC1
SCHEMBL4456087 0.89 ATM (0.59) ATMEGFRMAPTGAAALDH1A1
SCHEMBL4448831 0.89 ATM (0.59) ATMKCNMA1EGFRMAPTGAA
SCHEMBL4453773 0.88 KCNMA1 (0.46) ATMKCNMA1SMN1; SMN2RAB9ANPC1
SCHEMBL1134835 0.87 ATM (0.61) ATMEGFRMAPTGAAALDH1A1
SCHEMBL29445412 0.87 ATM (0.61) ATMEGFRMAPTGAAALDH1A1
SCHEMBL4447678 0.87 LMNA (0.60) KCNMA1SMN1; SMN2RAB9ANPC1HPGD
SCHEMBL2341630 0.84 ATM (0.56) ATMEGFRMAPTGAAALDH1A1
SCHEMBL646511 0.83 ATM (0.62) ATMEGFRMAPTGAAALDH1A1
SCHEMBL4920642 0.83 ATM (0.59) ATMEGFRMAPTGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 US claimed
US-20080153707-A1 Pyrazolecarboxanilides, Process for Their Preparation and Compositions Comprising Them for Controlling Harmful Fungi BASF AKITENGESELLSCHAFT (DE) 2008-06-26 US claimed
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides BASF AKTIENGESELLSCHAFT (DE) 2009-02-12 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 (2 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-20080153707-A1 Pyrazolecarboxanilides, Process for Their Preparation and Compositions Comprising Them for Controlling Harmful Fungi CBR3, C1S, PYM1 ATM 2473/4885KCNMA1 1407/4885EGFR 4373/4885
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides CBR3, CBR1, SNU13 ATM 4775/4885KCNMA1 1327/4885EGFR 3906/4885

“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.