SCHEMBL20636701

SCHEMBL20636701

Cn1c(-c2nn3cc(C(F)(F)F)ccc3c2I)nc2cc(C(F)(F)F)cnc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ MAOB P27338 1/20 0.36
▸ MAPK14 Q16539 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ STAT3 P40763 1/20 0.34
▸ STAT1 P42224 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ SENP8 Q96LD8 1/20 0.34
▸ SENP7 Q9BQF6 1/20 0.34
▸ SENP6 Q9GZR1 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ HTR2B P41595 1/20 0.32
▸ HTR6 P50406 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PDE10A Q9Y233 3/20 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
SCHEMBL20636699 0.83 POLB (0.44) POLBMAOBMAPK14ALDH1A1NPC1
SCHEMBL24868761 0.82 POLB (0.41) POLBMAOBMAPK14ALDH1A1NPC1
SCHEMBL20636704 0.78 POLB (0.40) POLBALDH1A1NPC1RAB9AMEN1
SCHEMBL20636693 0.77 POLB (0.41) POLBMAOBALDH1A1NPC1RAB9A
SCHEMBL19711963 0.76 POLB (0.40) POLBMAOBALDH1A1MEN1KMT2A
SCHEMBL20636697 0.75 POLB (0.42) POLBALDH1A1NPC1RAB9AMEN1
SCHEMBL19993455 0.74 POLB (0.40) POLBALDH1A1NPC1RAB9AMEN1
SCHEMBL24868774 0.74 POLB (0.40) POLBMAOBALDH1A1NPC1RAB9A
SCHEMBL23956549 0.73 POLB (0.37) POLBALDH1A1NPC1RAB9AMEN1
SCHEMBL19711946 0.73 POLB (0.41) POLBALDH1A1NPC1RAB9AMEN1

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 POLB 4343/4885MAOB 1373/4885MAPK14 3602/4885
US-20200223868-A1 CONDENSED HETEROCLYCLIC COMPOUNDS AND PESTICIDES CHRM1, HCRTR1, NR4A1 POLB 4742/4885MAOB 1676/4885MAPK14 3378/4885
US-10544163-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 POLB 4393/4885MAOB 1431/4885MAPK14 3649/4885
US-20200095263-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND PESTICIDES NR4A1, CHRM1, NR1D2 POLB 4393/4885MAOB 1431/4885MAPK14 3649/4885
US-10640518-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 POLB 4297/4885MAOB 1322/4885MAPK14 3649/4885

“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.

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