SCHEMBL19823044

SCHEMBL19823044

c1cnc2[nH]cc(-c3ccc(CN4CCOCC4)cc3)c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.59
MAP4K1 Q92918 1/20 0.56
CCNT1 O60563 1/20 0.53
CCNA2 P20248 1/20 0.53
CDK2 P24941 1/20 0.53
CDK9 P50750 1/20 0.53
HRH3 Q9Y5N1 1/20 0.51
TNIK Q9UKE5 4/20 0.51
CLK1 P49759 1/20 0.51
DYRK1A Q13627 1/20 0.51
CCNB2 O95067 1/20 0.49
CDK1 P06493 1/20 0.49
CCNB1 P14635 1/20 0.49
CCNB3 Q8WWL7 1/20 0.49
DRD4 P21917 4/20 0.49
HTR2A P28223 3/20 0.49
DRD2 P14416 2/20 0.49
DRD3 P35462 2/20 0.49
CAMKK2 Q96RR4 2/20 0.49
HTR7 P34969 2/20 0.48

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
SCHEMBL19823045 0.89 TNIK (0.54) CCNT1CCNA2CDK2CDK9TNIK
SCHEMBL19823067 0.86 TNIK (0.68) LRRK2MAP4K1CDK2TNIKCDK1
SCHEMBL19823109 0.85 TNIK (0.53) CDK2TNIKDRD4HTR2ADRD2
SCHEMBL19823048 0.84 TNIK (0.52) TNIKDRD4HTR2ADRD2DRD3
SCHEMBL19823047 0.84 TNIK (0.49) CDK2CDK9TNIKDYRK1ACDK1
SCHEMBL4792087 0.82 NEK1 (0.62) LRRK2MAP4K1CDK2CDK9HRH3
SCHEMBL857712 0.80 DRD4 (0.74) DRD4HTR2ADRD2DRD3HTR7
SCHEMBL21044844 0.79 CAMKK2 (0.54) CDK2CDK9TNIKDYRK1ACDK1
SCHEMBL19119615 0.78 MAP4K1 (0.56) LRRK2MAP4K1CDK2HRH3TNIK
SCHEMBL21506287 0.78 CCNC (0.49) LRRK2MAP4K1CCNT1CCNA2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11279699-B2 Compound as selective JAK inhibitor, and salt and therapeutic use thereof SUZHOU LONGBIOTECH PHARMACEUTICALS CO., LTD. (CN) 2022-03-22 US claimed
US-20200190080-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF TIANJIN LONGBOGENE PHARMACEUTICAL CO., LTD. (CN) 2020-06-18 US claimed
EP-3492469-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF Tianjin Longbogene Pharmaceutical Co., Ltd. (CN) 2019-06-05 EP claimed
CN-109843883-A Alternatively property JAK inhibitor compound, the salt and its therapeutical uses of the compound 天津隆博基因药物科技有限公司 2019-06-04 CN claimed
US-11279699-B2 Compound as selective JAK inhibitor, and salt and therapeutic use thereof SUZHOU LONGBIOTECH PHARMACEUTICALS CO., LTD. (CN) 2022-03-22 US disclosed
CN-109843883-B Compounds as selective JAK inhibitors, salts of the compounds and therapeutic uses thereof 苏州隆博泰药业有限公司 2022-01-14 CN disclosed
EP-3492469-B1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF SUZHOU LONGBIOTECH PHARMACEUTICALS CO LTD (CN) 2021-12-01 EP disclosed
EP-3492469-B1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF SUZHOU LONGBIOTECH PHARMACEUTICALS CO LTD (CN) 2021-12-01 EP disclosed
US-20200190080-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF TIANJIN LONGBOGENE PHARMACEUTICAL CO., LTD. (CN) 2020-06-18 US disclosed
EP-3492469-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF Tianjin Longbogene Pharmaceutical Co., Ltd. (CN) 2019-06-05 EP disclosed
EP-3492469-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF Tianjin Longbogene Pharmaceutical Co., Ltd. (CN) 2019-06-05 EP disclosed
CN-109843883-A Alternatively property JAK inhibitor compound, the salt and its therapeutical uses of the compound 天津隆博基因药物科技有限公司 2019-06-04 CN disclosed
WO-2018019223-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF 张文燕 2018-02-01 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-20200190080-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF JAK1, JAK2, JAK3 LRRK2 407/4885MAP4K1 141/4885CCNT1 872/4885
US-11279699-B2 Compound as selective JAK inhibitor, and salt and therapeutic use thereof JAK1, JAK2, JAK3 LRRK2 407/4885MAP4K1 141/4885CCNT1 872/4885

“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.