SCHEMBL4453763

SCHEMBL4453763

Cn1cc(C(=O)Nc2ccccc2-c2ccc(Cl)cc2Cl)c(C(F)(Cl)Cl)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
POLB P06746 1/20 0.52
CHRM3 P20309 1/20 0.46
ALDH1A1 P00352 3/20 0.43
JAK2 O60674 6/20 0.42
JAK1 P23458 4/20 0.42
TYK2 P29597 1/20 0.42
JAK3 P52333 1/20 0.42
LRRK2 Q5S007 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
RAB9A P51151 2/20 0.42
USP2 O75604 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ATM Q13315 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 2/20 0.40

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
SCHEMBL4443888 0.94 LMNA (0.52) LMNAPOLBCHRM3ALDH1A1JAK2
SCHEMBL302846 0.93 LMNA (0.61) LMNAPOLBCHRM3ALDH1A1JAK2
SCHEMBL4918010 0.86 LMNA (0.51) LMNAPOLBCHRM3ALDH1A1JAK2
SCHEMBL302426 0.85 LMNA (0.64) LMNAPOLBJAK2JAK1TYK2
SCHEMBL4914108 0.84 CHRM3 (0.49) LMNAPOLBCHRM3MAPK1ATM
SCHEMBL4448831 0.84 ATM (0.59) CHRM3ALDH1A1JAK2JAK1TYK2
SCHEMBL4455673 0.84 LMNA (0.60) LMNAPOLBJAK2JAK1MEN1
SCHEMBL4447678 0.84 LMNA (0.60) LMNAPOLBCHRM3JAK2JAK1
SCHEMBL2350381 0.84 LMNA (0.47) LMNAPOLBCHRM3ALDH1A1JAK2
SCHEMBL4443882 0.84 CHRM3 (0.48) LMNAPOLBCHRM3ALDH1A1JAK2

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 LMNA 1073/4885POLB 2358/4885CHRM3 222/4885
US-20090042724-A1 Fungicidal mixtures based on 2,4-disubstituted n-biphenylpyrazolecarboxamides CBR3, CBR1, SNU13 LMNA 3266/4885POLB 3502/4885CHRM3 766/4885

“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.