SCHEMBL23579441

SCHEMBL23579441

CC(C)(C)OC(=O)N1CCCC1COc1cnccc1Br

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.47
FEN1 P39748 1/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
CHRNB4 P30926 1/20 0.46
CHRNA3 P32297 1/20 0.46
UCHL1 P09936 1/20 0.44
F2RL3 Q96RI0 4/20 0.43
FPR3 P25089 1/20 0.43
FPR2 P25090 1/20 0.43
GPR119 Q8TDV5 5/20 0.41

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
SCHEMBL29529581 1.00 ALOX5AP (0.47) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL30743365 1.00 ALOX5AP (0.47) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL26783267 1.00 ALOX5AP (0.47) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL29529911 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL24399166 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL23605880 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL29508261 0.94 GPR119 (0.43) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL22602644 0.86 ALOX5AP (0.48) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL22602678 0.86 ALOX5AP (0.48) ALOX5APFEN1CHRNB2CHRNA4CHRNB4
SCHEMBL29102386 0.86 ALOX5AP (0.48) ALOX5APFEN1CHRNB2CHRNA4CHRNB4

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
US-12570631-B2 Substituted N-(4-(pyrimidin and pyridin-4-yl)benzylcarboxamides and its use for treating disorders responsive to inhibition of Btk BIOGEN MA INC. (US) 2026-03-10 US disclosed
US-20230121818-A1 BTK INHIBITORS BIOGEN MA INC. 2023-04-20 US disclosed
EP-4081514-A1 BTK INHIBITORS Biogen MA Inc. (US) 2022-11-02 EP disclosed
WO-2021133894-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2021-07-01 WO disclosed
WO-2021133894-A1 BTK INHIBITORS BIOGEN MA INC. (US) 2021-07-01 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-20230121818-A1 BTK INHIBITORS BTK, SYK, LYN ALOX5AP 4471/4885FEN1 3710/4885CHRNB2 3434/4885
US-12570631-B2 Substituted N-(4-(pyrimidin and pyridin-4-yl)benzylcarboxamides and its use for treating disorders responsive to inhibition of Btk BTK, LYN, SYK ALOX5AP 4081/4885FEN1 3459/4885CHRNB2 2813/4885

“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.