SCHEMBL22831367

SCHEMBL22831367

CN(C)CCOc1cccc(F)c1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 3/20 0.65
▸ CHRNA4 P43681 3/20 0.65
▸ KDM4E B2RXH2 4/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ LTA4H P09960 2/20 0.54
▸ TAAR1 Q96RJ0 1/20 0.51
▸ KEAP1 Q14145 1/20 0.50
▸ NFE2L2 Q16236 1/20 0.50
▸ ESR1 P03372 1/20 0.50
▸ MAPT P10636 1/20 0.49
▸ HRH3 Q9Y5N1 1/20 0.47

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
SCHEMBL30174226 1.00 CHRNB2 (0.65) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL22837826 0.91 KDM4E (0.56) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL22831321 0.89 CHRNB2 (0.51) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL31623324 0.89 CHRNB2 (0.51) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL21444471 0.81 MAPT (0.60) CHRNB2CHRNA4KDM4ELTA4HKEAP1
SCHEMBL16858365 0.80 CHRNB2 (0.67) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL5025139 0.80 CHRNB2 (0.67) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL8360713 0.80 CHRNB2 (0.67) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL30862627 0.80 CHRNB2 (0.67) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL255563 0.79 KMT2A (0.54) KDM4E

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-12582963-B2 Separation matrix and method of separation CYTIVA BIOPROCESS R&D AB (SE) 2026-03-24 — — US disclosed
EP-4142930-B1 SEPARATION MATRIX AND METHOD OF SEPARATION PURIDIFY LTD (GB) 2024-05-08 — — EP disclosed
US-20230191368-A1 Separation Matrix and Method of Separation CYTIVA BIOPROCESS R&D AB (SE) 2023-06-22 — — US disclosed
US-20210069692-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESINS BIO-RAD LABORATORIES, INC. 2021-03-11 — — US disclosed
US-20200406232-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESIN BIO-RAD LABORATORIES, INC. 2020-12-31 — — US disclosed
US-20200406232-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESIN BIO-RAD LABORATORIES, INC. 2020-12-31 — — 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 (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-20200406232-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESIN FCGRT, PBRM1, BCR CHRNB2 2470/4885CHRNA4 1929/4885KDM4E 1451/4885
US-20210069692-A1 ANIONIC EXCHANGE-HYDROPHOBIC MIXED MODE CHROMATOGRAPHY RESINS ABCG2, SLC7A1, MSR1 CHRNB2 2691/4885CHRNA4 2081/4885KDM4E 3830/4885
US-12582963-B2 Separation matrix and method of separation EPCAM, PA2G4, MAG CHRNB2 1390/4885CHRNA4 586/4885KDM4E 1482/4885

“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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