SCHEMBL683945

SCHEMBL683945

Cc1cc(/C=N/NC(=O)c2ccc(Cl)cc2)c(O)c(C(F)(F)F)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.58
KMT2A Q03164 5/20 0.58
SIRT1 Q96EB6 4/20 0.58
KDM4E B2RXH2 4/20 0.58
MEN1 O00255 4/20 0.58
LMNA P02545 2/20 0.58
HTT P42858 2/20 0.58
NPC1 O15118 4/20 0.53
MAPT P10636 3/20 0.53
PKM P14618 1/20 0.53
ATM Q13315 1/20 0.53
KDM1A O60341 1/20 0.51
TDP1 Q9NUW8 3/20 0.49
ALOX5 P09917 2/20 0.49
PTGS2 P35354 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
PSMD14 O00487 1/20 0.49
POLB P06746 1/20 0.49
MMP2 P08253 1/20 0.49
BLM P54132 1/20 0.49

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
SCHEMBL684720 0.92 SIRT1 (0.62) RAB9AKMT2ASIRT1KDM4EMEN1
SCHEMBL685015 0.91 RAB9A (0.55) RAB9AKMT2ASIRT1MEN1LMNA
SCHEMBL684761 0.90 SIRT1 (0.61) RAB9AKMT2ASIRT1KDM4EMEN1
SCHEMBL684644 0.89 SIRT1 (0.59) RAB9AKMT2ASIRT1KDM4EMEN1
SCHEMBL685251 0.88 ALOX5 (0.63) RAB9AKMT2ASIRT1KDM4ELMNA
SCHEMBL684725 0.88 KDM1A (0.58) RAB9AKMT2AKDM4EMEN1LMNA
SCHEMBL686471 0.87 SIRT1 (0.60) RAB9AKMT2ASIRT1KDM4EMEN1
SCHEMBL683946 0.85 PHGDH (0.61) RAB9AKMT2ASIRT1KDM4EMEN1
SCHEMBL683936 0.84 KMT2A (0.64) RAB9AKMT2ASIRT1KDM4EMEN1
SCHEMBL684614 0.84 LMNA (0.53) RAB9AKMT2ASIRT1KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-06-14 US disclosed
US-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER DOW AGROSCIENCES LLC (US) 2012-01-12 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-20120010075-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, SOD3 RAB9A 3846/4885KMT2A 1362/4885SIRT1 2400/4885
US-20120148682-A1 FUNGICIDAL COMPOSITIONS INCLUDING HYDRAZONE DERIVATIVES AND COPPER SOD1, CYP51A1, CYP4Z1 RAB9A 3616/4885KMT2A 1224/4885SIRT1 1977/4885

“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.