SCHEMBL17137356

SCHEMBL17137356

COc1cc2c(cc1Br)CN(S(=O)(=O)c1ccc(C)cc1)CC2=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.51
STAT3 P40763 1/20 0.51
MCOLN3 Q8TDD5 3/20 0.46
RYR2 Q92736 1/20 0.45
LMNA P02545 2/20 0.44
GAA P10253 4/20 0.44
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
PKM P14618 1/20 0.44
POLB P06746 1/20 0.44
TSHR P16473 3/20 0.43
KCNN4 O15554 1/20 0.43
KCNA3 P22001 1/20 0.43
ATM Q13315 1/20 0.42
USP2 O75604 1/20 0.41
HDAC1 Q13547 1/20 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
SCHEMBL4715745 0.91 PKM (0.52) ALDH1A1KDM4ESTAT3MCOLN3RYR2
SCHEMBL29108055 0.81 PKM (0.68) ALDH1A1KDM4ESTAT3MCOLN3RYR2
SCHEMBL25422392 0.80 HDAC1 (0.46) ALDH1A1RYR2GAAKMT2AMEN1
SCHEMBL13171923 0.80 KCNN4 (0.46) ALDH1A1RYR2GAAKMT2AMEN1
SCHEMBL9602776 0.79 PKM (0.64) ALDH1A1MCOLN3RYR2LMNAGAA
SCHEMBL21315085 0.79 KCNN4 (0.47) ALDH1A1RYR2GAAKMT2AMEN1
SCHEMBL7496042 0.76 RYR2 (0.49) ALDH1A1KDM4ESTAT3MCOLN3RYR2
SCHEMBL16858559 0.75 KCNN4 (0.43) ALDH1A1RYR2LMNAGAAKMT2A
SCHEMBL3680871 0.74 KCNN4 (0.60) ALDH1A1LMNAGAAKMT2APKM
SCHEMBL25427563 0.74 ALDH1A1 (0.46) ALDH1A1KDM4ESTAT3MCOLN3RYR2

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12202836-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2025-01-21 US disclosed
US-20230339960-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER (US) 2023-10-26 US disclosed
US-11702424-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2023-07-18 US disclosed
EP-3536685-B1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AND THEIR USE AS IRAK4 INHIBITORS PFIZER (US) 2022-02-16 EP disclosed
EP-3858825-A1 BICYCLIC-FUSED HETEROARYL COMPOUNDS AS IRAK4 MODULATORS Pfizer Inc. (US) 2021-08-04 EP disclosed
EP-3858825-A1 BICYCLIC-FUSED HETEROARYL COMPOUNDS AS IRAK4 MODULATORS Pfizer Inc. (US) 2021-08-04 EP disclosed
EP-3341367-B1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AS IRAK4 MODULATORS PFIZER (US) 2021-02-24 EP disclosed
EP-3341367-B1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AS IRAK4 MODULATORS PFIZER (US) 2021-02-24 EP disclosed
CN-107949559-B Bicyclic fused heteroaryl or aryl compounds as IRAK4 modulators 辉瑞公司 2020-12-11 CN disclosed
US-20200377511-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER INC. (US) 2020-12-03 US disclosed
US-20190092750-A1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AS IRAK4 MODULATORS PFIZER INC. (US) 2019-03-28 US disclosed
US-10174000-B2 Bicyclic-fused heteroaryl or aryl compounds as IRAK4 modulators PFIZER INC. (US) 2019-01-08 US disclosed
US-10174000-B2 Bicyclic-fused heteroaryl or aryl compounds as IRAK4 modulators PFIZER INC. (US) 2019-01-08 US disclosed
US-20180244646-A1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AS IRAK4 MODULATORS PFIZER INC. (US) 2018-08-30 US disclosed
US-20180127432-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER INC. (US) 2018-05-10 US disclosed
US-9879022-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2018-01-30 US disclosed
WO-2017033093-A1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AS IRAK4 MODULATORS PFIZER INC. (US) 2017-03-02 WO disclosed
US-20160347760-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER INC. (US) 2016-12-01 US disclosed
US-9458168-B2 Bicyclic-fused heteroaryl or aryl compounds PFIZER INC. (US) 2016-10-04 US disclosed
US-20150284405-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds PFIZER INC. (US) 2015-10-08 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 (10 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-20160347760-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds UGT2B7, CYP3A43, CYP3A4 ALDH1A1 594/4885KDM4E 3965/4885STAT3 3501/4885
US-10174000-B2 Bicyclic-fused heteroaryl or aryl compounds as IRAK4 modulators IRAK4, IRAK2, IRAK3 ALDH1A1 3199/4885KDM4E 112/4885STAT3 54/4885
US-20180244646-A1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AS IRAK4 MODULATORS IRAK4, IRAK2, IRAK3 ALDH1A1 3199/4885KDM4E 112/4885STAT3 54/4885
US-20150284405-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds UGT2B7, CYP3A43, CYP3A4 ALDH1A1 594/4885KDM4E 3965/4885STAT3 3501/4885
US-20200377511-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds UGT2B7, CYP3A43, CYP3A4 ALDH1A1 594/4885KDM4E 3965/4885STAT3 3501/4885
US-20190092750-A1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AS IRAK4 MODULATORS IRAK4, IRAK2, IRAK3 ALDH1A1 2948/4885KDM4E 113/4885STAT3 47/4885
US-20230339960-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds TTR, TYR, ABL1 ALDH1A1 1068/4885KDM4E 2785/4885STAT3 120/4885
US-12202836-B2 Bicyclic-fused heteroaryl or aryl compounds TTR, TYR, ABL1 ALDH1A1 1068/4885KDM4E 2785/4885STAT3 120/4885
US-20180127432-A1 Bicyclic-Fused Heteroaryl or Aryl Compounds UGT2B7, CYP3A43, CYP3A4 ALDH1A1 594/4885KDM4E 3965/4885STAT3 3501/4885
US-11702424-B2 Bicyclic-fused heteroaryl or aryl compounds UGT2B7, CYP3A43, CYP3A4 ALDH1A1 594/4885KDM4E 3965/4885STAT3 3501/4885

“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.