SCHEMBL20636705

SCHEMBL20636705

CCSc1c(C(C)=O)nn2ccc(C(F)(F)F)cc12

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.34
HTT P42858 1/20 0.34
GFER P55789 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SLC2A1 P11166 1/20 0.33
POLB P06746 1/20 0.33
DDR1 Q08345 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MAT2A P31153 3/20 0.32
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32
GRIN2B Q13224 1/20 0.31

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
SCHEMBL20636708 0.90 POLB (0.37) KMT2AATMHTTGFERPTGDR2
Hydrochloric Acid SCHEMBL20636716 0.89 POLB (0.37) KMT2AATMHTTGFERPTGDR2
SCHEMBL20636714 0.89 HTT (0.36) KMT2AHTTGFERPTGDR2NPC1
SCHEMBL20636702 0.86 MAPT (0.39) KMT2AALDH1A1KDM4E
SCHEMBL20636712 0.83 MLYCD (0.34) HTTGFERPTGDR2NPC1RAB9A
SCHEMBL20636710 0.78 POLB (0.39) KMT2AATMHTTPTGDR2POLB
SCHEMBL20636695 0.73 PDE10A (0.37) MAT2ALMNA
SCHEMBL25251710 0.71 POLB (0.39) KMT2AATMHTTPTGDR2NPC1
SCHEMBL19711920 0.71 USP7 (0.39) KMT2AATMGFERPTGDR2NPC1
SCHEMBL20636720 0.70 MAPT (0.41) KMT2AALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10759815-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-09-01 US disclosed
US-20200223868-A1 CONDENSED HETEROCLYCLIC COMPOUNDS AND PESTICIDES NISSAN CHEMICAL CORPORATION (JP) 2020-07-16 US disclosed
US-10640518-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-05-05 US disclosed
US-20200095263-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND PESTICIDES NISSAN CHEMICAL CORPORATION (JP) 2020-03-26 US disclosed
US-10544163-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-01-28 US disclosed
EP-3428166-A1 CONDENSED HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT Nissan Chemical Corporation (JP) 2019-01-16 EP 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 (5 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-10759815-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 KMT2A 1380/4885ATM 3727/4885HTT 1169/4885
US-20200223868-A1 CONDENSED HETEROCLYCLIC COMPOUNDS AND PESTICIDES CHRM1, HCRTR1, NR4A1 KMT2A 2177/4885ATM 4037/4885HTT 1338/4885
US-10544163-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 KMT2A 1681/4885ATM 3691/4885HTT 1214/4885
US-20200095263-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND PESTICIDES NR4A1, CHRM1, NR1D2 KMT2A 1681/4885ATM 3691/4885HTT 1214/4885
US-10640518-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 KMT2A 1336/4885ATM 3760/4885HTT 1258/4885

“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.