SCHEMBL19002027

SCHEMBL19002027

CC(C)(C)OC(=O)N1CCC(n2nc(Br)c(C#N)c2N)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 13/20 0.42
CTSD P07339 1/20 0.40
CTSE P14091 1/20 0.40
BACE1 P56817 1/20 0.40
KCNH2 Q12809 1/20 0.39
DPP4 P27487 1/20 0.39
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
HPGD P15428 1/20 0.38

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
SCHEMBL28703609 0.94 GPR119 (0.40) GPR119DPP4JAK2
SCHEMBL21114947 0.94 GPR119 (0.40) GPR119DPP4JAK2
SCHEMBL21114946 0.94 GPR119 (0.40) GPR119DPP4JAK2
SCHEMBL28679492 0.89 KCNH2 (0.37) GPR119KCNH2
SCHEMBL16979065 0.84 KRAS (0.41) GPR119KCNH2JAK2
SCHEMBL18996823 0.83 BTK (0.40)
SCHEMBL26760030 0.82 GPR119 (0.41) GPR119KCNH2
SCHEMBL28995746 0.82 GPR119 (0.41) GPR119KCNH2
SCHEMBL19001733 0.79 GPR119 (0.47) GPR119CTSDCTSEBACE1
SCHEMBL21115007 0.79 GPR119 (0.39) GPR119KCNH2JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025137329-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS NEUPHARMA, INC (US) 2025-06-26 WO disclosed
CN-114075168-A Pyrazole derivative and application thereof in medicine 海思科医药集团股份有限公司 2022-02-22 CN disclosed
CN-113999233-A BTK inhibitor ring derivative, preparation method and pharmaceutical application thereof 四川海思科制药有限公司 2022-02-01 CN disclosed
US-20210009567-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2021-01-14 US disclosed
US-20200055843-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2020-02-20 US disclosed
US-20190092759-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2019-03-28 US disclosed
US-20180222893-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2018-08-09 US disclosed
US-9975882-B2 Heteroaromatic compounds as BTK inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-05-22 US disclosed
US-9815822-B2 2017-11-14 US disclosed
US-20170174663-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-06-22 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 (5 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-20180222893-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK GPR119 2616/4885CTSD 2125/4885CTSE 1297/4885
US-20200055843-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK GPR119 2616/4885CTSD 2125/4885CTSE 1297/4885
US-20170174663-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK GPR119 2616/4885CTSD 2125/4885CTSE 1297/4885
US-20190092759-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK GPR119 2616/4885CTSD 2125/4885CTSE 1297/4885
US-20210009567-A1 HETEROAROMATIC COMPOUNDS AS BTK INHIBITORS BTK, SYK, LCK GPR119 2616/4885CTSD 2125/4885CTSE 1297/4885

“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.