SCHEMBL3201742

SCHEMBL3201742

CC(C)(F)c1ncncn1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.35

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
SCHEMBL3677995 0.77 HSP90AA1 (0.38) HSP90AA1
SCHEMBL31692011 0.74 HDAC8 (0.32) HSP90AA1
SCHEMBL22402401 0.72 HSP90AA1 (0.35) HSP90AA1
SCHEMBL14696064 0.72 HSP90AA1 (0.35) HSP90AA1
SCHEMBL16677127 0.69 HSP90AA1 (0.32) HSP90AA1
SCHEMBL10460630 0.69 HSP90AA1 (0.32) HSP90AA1
SCHEMBL14816179 0.69 HSP90AA1 (0.38) HSP90AA1
SCHEMBL22413865 0.69 HSP90AA1 (0.32) HSP90AA1
SCHEMBL16793394 0.69 KDM4E (0.35)
SCHEMBL19307839 0.67 SHBG (0.35) HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113683531-B Method for preparing perfluoronitrile by pyrolysis and fluorination 化学与精细化工广东省实验室 2023-10-27 CN disclosed
CN-113683531-A Method for preparing perfluoronitrile by pyrolysis fluorination 化学与精细化工广东省实验室 2021-11-23 CN disclosed
CN-1237336-B Selective herbicidal composition BAYER AGROCHEM KK 2010-09-29 CN disclosed
US-20100048400-A1 HERBICIDE COMBINATION BAYER CROPSCIENCE AG (DE) 2010-02-25 US disclosed
US-20070123424-A1 AQUEOUS SUSPENSION CONCENTRATES BAYER CROPSCIENCE GMBH (DE) 2007-05-31 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-20070123424-A1 AQUEOUS SUSPENSION CONCENTRATES ASH2L, SPATS2L, AS3MT HSP90AA1 3963/4885
US-20100048400-A1 HERBICIDE COMBINATION DDT, DRD1, DRD2 HSP90AA1 464/4885

“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.