SCHEMBL16337022

SCHEMBL16337022

Cc1ccc(-c2cc3c(I)ccc(C(N)=O)c3[nH]2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 15/20 0.66
CHEK1 O14757 2/20 0.63
PLK4 O00444 1/20 0.63
DAPK3 O43293 1/20 0.63
PRKD3 O94806 1/20 0.63
MAP4K4 O95819 1/20 0.63
PAK4 O96013 1/20 0.63
ABL1 P00519 1/20 0.63
PRKCG P05129 1/20 0.63
FYN P06241 1/20 0.63
CSF1R P07333 1/20 0.63
LYN P07948 1/20 0.63
RET P07949 1/20 0.63
PDGFRB P09619 1/20 0.63
KIT P10721 1/20 0.63
SRC P12931 1/20 0.63
PDGFRA P16234 1/20 0.63
FER P16591 1/20 0.63
PRKACA P17612 1/20 0.63
FLT1 P17948 1/20 0.63

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
SCHEMBL16336006 0.80 BTK (1.00) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL29709483 0.80 BTK (1.00) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL16338243 0.80 BTK (0.71) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL16340450 0.80 BTK (0.48) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL16382685 0.79 BTK (0.48) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL6028389 0.79 DHODH (0.59) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL16336471 0.79 BTK (1.00) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL21008640 0.79 BTK (0.60) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL29709597 0.79 BTK (0.80) BTKCHEK1PLK4DAPK3PRKD3
SCHEMBL16337965 0.79 BTK (0.80) BTKCHEK1PLK4DAPK3PRKD3

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
US-20210179556-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS ABBVIE INC. 2021-06-17 US disclosed
CN-105530932-B Primary formamide as BTK inhibitor 艾伯维公司 2019-09-27 CN 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-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
CN-105530932-A Primary carboxamides as BIK inhibitors ABBVIE INC 2016-04-27 CN 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 BTK 1/4885CHEK1 460/4885PLK4 1762/4885
US-20150005279-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 BTK 1/4885CHEK1 460/4885PLK4 1762/4885
US-20190284135-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 BTK 1/4885CHEK1 460/4885PLK4 1762/4885
US-20170174624-A1 PRIMARY CARBOXAMIDES AS BTK INHIBITORS BTK, SYK, MYD88 BTK 1/4885CHEK1 460/4885PLK4 1762/4885

“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.