SCHEMBL22773286

SCHEMBL22773286

CCN(CC)CCOc1ccc(/C=C(\C)c2ccc(O)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 17/20 0.63
ESR2 Q92731 16/20 0.63
EBP Q15125 1/20 0.56
SIGMAR1 Q99720 1/20 0.56
BCHE P06276 1/20 0.50
ACHE P22303 1/20 0.50
ESRRG P62508 1/20 0.50
MAOB P27338 1/20 0.50

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
SCHEMBL19643767 1.00 ESR1 (0.63) ESR1ESR2EBPSIGMAR1BCHE
SCHEMBL19644197 0.90 EBP (0.56) ESR1ESR2EBPSIGMAR1BCHE
SCHEMBL22773360 0.90 EBP (0.56) ESR1ESR2EBPSIGMAR1BCHE
SCHEMBL19642705 0.90 EBP (0.56) ESR1ESR2EBPSIGMAR1BCHE
SCHEMBL19642759 0.88 BCHE (0.64) ESR1ESR2EBPSIGMAR1BCHE
SCHEMBL19642760 0.88 BCHE (0.64) ESR1ESR2EBPSIGMAR1BCHE
SCHEMBL4693255 0.83 ESR1 (0.70) ESR1ESR2EBPSIGMAR1MAOB
SCHEMBL22773260 0.82 BCHE (0.65) ESR1EBPSIGMAR1BCHEACHE
SCHEMBL19642914 0.82 BCHE (0.65) ESR1EBPSIGMAR1BCHEACHE
SCHEMBL11854557 0.78 ESR1 (0.52) ESR1ESR2

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-20240246904-A1 FUNCTIONALIZED N,N-DIALKYLAMINO PHENYL ETHERS AND THEIR METHOD OF USE UNIV TEMPLE (US) 2024-07-25 US claimed
US-11873267-B2 Functionalized N,N-dialkylamino phenyl ethers and their method of use TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2024-01-16 US claimed
US-20200392073-A1 NOVEL FUNCTIONALIZED N,N-DIALKYLAMINO PHENYL ETHERS AND THEIR METHOD OF USE TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2020-12-17 US claimed
US-20240246904-A1 FUNCTIONALIZED N,N-DIALKYLAMINO PHENYL ETHERS AND THEIR METHOD OF USE UNIV TEMPLE (US) 2024-07-25 US disclosed
US-11873267-B2 Functionalized N,N-dialkylamino phenyl ethers and their method of use TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2024-01-16 US disclosed
US-20200392073-A1 NOVEL FUNCTIONALIZED N,N-DIALKYLAMINO PHENYL ETHERS AND THEIR METHOD OF USE TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2020-12-17 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-11873267-B2 Functionalized N,N-dialkylamino phenyl ethers and their method of use GAA, GBA1, GBA2 ESR1 3412/4885ESR2 2929/4885EBP 2105/4885
US-20240246904-A1 FUNCTIONALIZED N,N-DIALKYLAMINO PHENYL ETHERS AND THEIR METHOD OF USE GAA, GBA1, GBA2 ESR1 3412/4885ESR2 2929/4885EBP 2105/4885
US-20200392073-A1 NOVEL FUNCTIONALIZED N,N-DIALKYLAMINO PHENYL ETHERS AND THEIR METHOD OF USE GAA, GBA1, GBA2 ESR1 3705/4885ESR2 3237/4885EBP 2176/4885

“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.