SCHEMBL16333786

SCHEMBL16333786

CC(C)(C)OC(=O)N1CCCC(n2cnc3ccc(F)cc3c2=O)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.54
BTK Q06187 2/20 0.49
PIK3CD O00329 4/20 0.45
PIK3CA P42336 4/20 0.45
PIK3CB P42338 3/20 0.45
PIK3CG P48736 3/20 0.45
PIK3R1 P27986 1/20 0.45
MTOR P42345 1/20 0.45
PIK3R5 Q8WYR1 1/20 0.45
IDO1 P14902 2/20 0.42
TDO2 P48775 1/20 0.42
IDO2 Q6ZQW0 1/20 0.42
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
CCNT1 O60563 2/20 0.41
CDK9 P50750 2/20 0.41
BRD3 Q15059 1/20 0.41
FPR2 P25090 1/20 0.40
CYP2D6 P10635 1/20 0.40
HPGDS O60760 1/20 0.40

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
SCHEMBL16336882 1.00 HCAR1 (0.54) HCAR1BTKPIK3CDPIK3CAPIK3CB
SCHEMBL29709458 0.86 HCAR1 (0.55) HCAR1BTKPIK3CDPIK3CAPIK3CB
SCHEMBL16335107 0.86 HCAR1 (0.55) HCAR1BTKPIK3CDPIK3CAPIK3CB
SCHEMBL16337414 0.86 HCAR1 (0.55) HCAR1BTKPIK3CDPIK3CAPIK3CB
SCHEMBL16334003 0.85 BTK (0.53) BTKPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL19118889 0.83 HCAR1 (0.52) HCAR1PIK3CAJAK2JAK1FPR2
SCHEMBL19118890 0.83 HCAR1 (0.52) HCAR1PIK3CAJAK2JAK1FPR2
SCHEMBL19118355 0.81 HCAR1 (0.49) HCAR1JAK2JAK1FPR2
SCHEMBL19118356 0.81 HCAR1 (0.49) HCAR1JAK2JAK1FPR2
SCHEMBL16334102 0.80 HCAR1 (0.48) HCAR1BTKIDO1TDO2JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4008328-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS AbbVie Inc. (US) 2022-06-08 EP disclosed
EP-4008328-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS AbbVie Inc. (US) 2022-06-08 EP disclosed
US-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. 2021-06-17 US disclosed
US-20190284135-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. 2019-09-19 US disclosed
EP-3483167-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS AbbVie Inc. (US) 2019-05-15 EP disclosed
EP-3483167-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS AbbVie Inc. (US) 2019-05-15 EP disclosed
EP-3013337-B1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC (US) 2018-10-31 EP disclosed
US-20170174624-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. (US) 2017-06-22 US disclosed
US-9567339-B2 Primary carboxamides as BTK inhibitors ABBVIE INC. (US) 2017-02-14 US disclosed
EP-3013337-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS Abbvie Inc. (US) 2016-05-04 EP disclosed
US-20150005279-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. (US) 2015-01-01 US disclosed
WO-2014210255-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. (US) 2014-12-31 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 (4 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-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 HCAR1 2417/4885BTK 1/4885PIK3CD 49/4885
US-20150005279-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 HCAR1 2417/4885BTK 1/4885PIK3CD 49/4885
US-20190284135-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 HCAR1 2417/4885BTK 1/4885PIK3CD 49/4885
US-20170174624-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 HCAR1 2417/4885BTK 1/4885PIK3CD 49/4885

“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.