Sugi Predict

Sugi Predict / Compounds / SCHEMBL12377615

SCHEMBL12377615

SCHEMBL12377615

Cc1cc(C(=O)Cl)cc(F)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES2 O00748 4/20 0.46
▸ CES1 P23141 4/20 0.46
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC6 Q9UBN7 2/20 0.39
▸ POLB P06746 1/20 0.35
▸ KCNQ3 O43525 2/20 0.35
▸ KCNQ2 O43526 2/20 0.35
▸ KCNE1 P15382 2/20 0.35
▸ KCNQ1 P51787 2/20 0.35
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA4 P22748 2/20 0.34
▸ ALDH1A1 P00352 4/20 0.33
▸ LMNA P02545 3/20 0.33
▸ HTT P42858 3/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ KCNQ5 Q9NR82 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ TP53 P04637 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
SCHEMBL16338726 0.89 CES2 (0.36) CES2CES1HDAC1HDAC6POLB
SCHEMBL193908 0.84 CES2 (0.64) CES2CES1HDAC1HDAC6KCNQ3
SCHEMBL2183846 0.81 CES2 (0.48) CES2CES1HDAC1HDAC6CA1
SCHEMBL13293382 0.81 CES2 (0.48) CES2CES1HDAC1HDAC6CA1
SCHEMBL987144 0.80 HDAC1 (0.57) CES2CES1HDAC1HDAC6KCNQ3
SCHEMBL31701851 0.80 HDAC1 (0.41) CES2CES1HDAC1HDAC6KCNQ3
SCHEMBL5948933 0.78 CES2 (0.50) CES2CES1HDAC1HDAC6CA1
SCHEMBL7922027 0.77 CES2 (0.48) CES2CES1HDAC1HDAC6KCNQ3
SCHEMBL23905293 0.76 MAPT (0.44) CES2CES1HDAC1HDAC6ALDH1A1
SCHEMBL21712059 0.76 KDM4E (0.52) CES2CES1HDAC1HDAC6POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003699-B2 Amide compound and use thereof for controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-23 — — US disclosed
US-20100137445-A1 PLANT DISEASE CONTROL AGENT, AND PLANT DISEASE CONTROL METHOD SUMITOMO CHEMICAL COMPANY ,LIMITED 2010-06-03 — — US disclosed
US-20100105647-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED 2010-04-29 — — US disclosed
US-20100069499-A1 AMIDE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 — — 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 (3 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-20100069499-A1 AMIDE COMPOUND AND USE THEREOF CBR1, CBR3, GBA1 CES2 118/4885CES1 116/4885HDAC1 159/4885
US-20100105647-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES CYC1, CBR3, CBR1 CES2 660/4885CES1 233/4885HDAC1 659/4885
US-20100137445-A1 PLANT DISEASE CONTROL AGENT, AND PLANT DISEASE CONTROL METHOD CBR3, CBR1, HDHD5 CES2 675/4885CES1 223/4885HDAC1 959/4885

“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.