SCHEMBL4914980

SCHEMBL4914980

Cn1cc(C(=O)Nc2ccccc2-c2ccc(Cl)c(Cl)c2)c(C(F)(F)Cl)n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
POLB P06746 2/20 0.47
CHRM3 P20309 7/20 0.46
NTRK1 P04629 4/20 0.42
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
LRRK2 Q5S007 1/20 0.39
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL2350381 0.94 LMNA (0.47) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL2351992 0.93 LMNA (0.55) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL4913373 0.92 CHRM3 (0.49) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL4918647 0.88 NTRK1 (0.47) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL4920459 0.88 LMNA (0.51) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL4914108 0.86 CHRM3 (0.49) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL4915327 0.86 CHRM3 (0.48) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL3540042 0.86 NTRK1 (0.53) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL1086049 0.85 NTRK1 (0.45) LMNAPOLBCHRM3NTRK1ATM
SCHEMBL4915607 0.84 ATM (0.59) LMNAPOLBCHRM3NTRK1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080153707-A1 Pyrazolecarboxanilides, Process for Their Preparation and Compositions Comprising Them for Controlling Harmful Fungi BASF AKITENGESELLSCHAFT (DE) 2008-06-26 US claimed

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-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

“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.