SCHEMBL18796008

SCHEMBL18796008

Cc1nc2c(F)c(F)ccc2cc1Oc1cccc(F)c1Br

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ PRNP P04156 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ FFAR1 O14842 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ STAT3 P40763 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL18796310 0.90 ALDH1A1 (0.39) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL18796273 0.89 MAPT (0.33) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL19472018 0.88 MAPT (0.35) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL18796171 0.87 MPL (0.32) —
SCHEMBL26440720 0.86 PDE2A (0.34) ALDH1A1MAPTESR1FFAR1LMNA
SCHEMBL20104491 0.86 KDM4E (0.38) ALDH1A1MAPTESR1FFAR1LMNA
SCHEMBL18796251 0.85 LMNA (0.39) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL18796398 0.84 MAP4K4 (0.34) ALDH1A1MAPTESR1FFAR1LMNA
SCHEMBL18796031 0.83 GCK (0.35) ALDH1A1MAPTPRNPNPSR1RXFP1
SCHEMBL21462376 0.82 KMT2A (0.32) ALDH1A1MAPTESR1

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
EP-3368514-B1 TRISUBSTITUTED SILYLPHENOXYHETEROCYCLES AND ANALOGUES BAYER CROPSCIENCE AG (DE) 2021-08-18 — — EP disclosed
US-10683311-B2 Trisubstitutedsilylphenoxyheterocycles and analogues BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-06-16 — — US disclosed
US-20190233444-A1 TRISUBSTITUTEDSILYLPHENOXYHETEROCYCLES AND ANALOGUES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-08-01 — — US disclosed
EP-3368514-A1 TRISUBSTITUTEDSILYLPHENOXYHETEROCYCLES AND ANALOGUES Bayer CropScience Aktiengesellschaft (DE) 2018-09-05 — — EP disclosed
WO-2017072283-A1 TRISUBSTITUTEDSILYLPHENOXYHETEROCYCLES AND ANALOGUES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-05-04 — — WO 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-10683311-B2 Trisubstitutedsilylphenoxyheterocycles and analogues PIK3C3, ERG28, DDT ALDH1A1 3139/4885MAPT 3403/4885PRNP 1390/4885
US-20190233444-A1 TRISUBSTITUTEDSILYLPHENOXYHETEROCYCLES AND ANALOGUES PIK3C3, ERG28, DDT ALDH1A1 3139/4885MAPT 3403/4885PRNP 1390/4885

“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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