SCHEMBL19025499

SCHEMBL19025499

CC(C)CC(C)(N)COc1ccc(-c2ccnc(C(F)F)c2)cc1OC(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AAK1 Q2M2I8 20/20 1.00
▸ CYP3A4 P08684 4/20 0.77
▸ PRKG2 Q13237 2/20 0.77
▸ MKNK2 Q9HBH9 2/20 0.77
▸ GSK3A P49840 1/20 0.77
▸ CIT O14578 3/20 0.76
▸ GAK O14976 3/20 0.76
▸ MKNK1 Q9BUB5 3/20 0.76
▸ BMP2K Q9NSY1 3/20 0.76
▸ ROCK2 O75116 1/20 0.76
▸ PKN2 Q16513 1/20 0.76
▸ SLC6A2 P23975 2/20 0.67
▸ KCNH2 Q12809 2/20 0.67
▸ LATS2 Q9NRM7 1/20 0.67
▸ ABCG2 Q9UNQ0 1/20 0.67
▸ CHRNA7 P36544 1/20 0.64
▸ MYLK2 Q9H1R3 1/20 0.64
▸ TNIK Q9UKE5 1/20 0.64

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
SCHEMBL30292383 1.00 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL17143799 1.00 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL30292361 0.87 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL17155505 0.87 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL19026356 0.87 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL17143712 0.86 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL30292388 0.86 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL19025596 0.86 AAK1 (1.00) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL28992899 0.85 AAK1 (0.78) AAK1CYP3A4PRKG2MKNK2GSK3A
SCHEMBL28992898 0.85 AAK1 (0.78) AAK1CYP3A4PRKG2MKNK2GSK3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3126351-B1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-09-19 — — EP claimed
US-9902722-B2 Biaryl kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-02-27 — — US claimed
US-20170183340-A1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-06-29 — — US claimed
US-20250262197-A1 COMPOUNDS AND METHODS FOR TREATING CHEMOTHERAPY-INDUCED PAIN LEXICON PHARMACEUTICALS, INC. (US) 2025-08-21 — — US disclosed
US-20240360131-A1 BIARYL KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2024-10-31 — — US disclosed
US-12065437-B2 Biaryl kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2024-08-20 — — US disclosed
WO-2023200892-A1 COMPOUNDS AND METHODS FOR TREATING SPASTICITY LEXICON PHARMACEUTICALS, INC. (US) 2023-10-19 — — WO disclosed
US-20230330074-A1 COMPOUNDS AND METHODS FOR TREATING SPASTICITY LEXICON PHARMACEUTICALS, INC. (US) 2023-10-19 — — US disclosed
US-11730723-B2 Compounds and methods for treating viral infections LEXICON PHARMACEUTICALS, INC. (US) 2023-08-22 — — US disclosed
EP-4138829-A1 AAK1 INHIBITORS FOR USE IN TREATING VIRAL INFECTIONS Lexicon Pharmaceuticals, Inc. (US) 2023-03-01 — — EP disclosed
US-20220054464-A1 COMPOUNDS AND METHODS FOR TREATING VIRAL INFECTIONS OXFORD FINANCE LLC 2022-02-24 — — US disclosed
US-20190048006-A1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2019-02-14 — — US disclosed
US-10155760-B2 Biaryl kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-12-18 — — US disclosed
US-20180346440-A1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-12-06 — — US disclosed
EP-3126351-B1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-09-19 — — EP disclosed
US-20180134704-A1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-05-17 — — US disclosed
US-20180134704-A1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-05-17 — — US disclosed
US-9902722-B2 Biaryl kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-02-27 — — US disclosed
US-9902722-B2 Biaryl kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2018-02-27 — — US disclosed
US-20170183340-A1 BIARYL KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-06-29 — — 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 (11 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-20180134704-A1 BIARYL KINASE INHIBITORS AAK1, NCK1, MARCKS AAK1 1/4885CYP3A4 4488/4885PRKG2 886/4885
US-20230330074-A1 COMPOUNDS AND METHODS FOR TREATING SPASTICITY SMN1; SMN2, MUSK, GAB1 AAK1 62/4885CYP3A4 4883/4885PRKG2 256/4885
US-20220054464-A1 COMPOUNDS AND METHODS FOR TREATING VIRAL INFECTIONS EIF2AK2, SARS1, MAVS AAK1 147/4885CYP3A4 4823/4885PRKG2 2295/4885
US-20170183340-A1 BIARYL KINASE INHIBITORS AAK1, NCK1, MARCKS AAK1 1/4885CYP3A4 4488/4885PRKG2 886/4885
US-12065437-B2 Biaryl kinase inhibitors AAK1, NCK1, MARCKS AAK1 1/4885CYP3A4 4488/4885PRKG2 886/4885
US-11730723-B2 Compounds and methods for treating viral infections EIF2AK2, SARS1, MAVS AAK1 147/4885CYP3A4 4823/4885PRKG2 2295/4885
US-20180346440-A1 BIARYL KINASE INHIBITORS AAK1, CAMKK1, CAMKK2 AAK1 1/4885CYP3A4 4285/4885PRKG2 562/4885
US-20190048006-A1 BIARYL KINASE INHIBITORS AAK1, NCK1, MARCKS AAK1 1/4885CYP3A4 4488/4885PRKG2 886/4885
US-10155760-B2 Biaryl kinase inhibitors AAK1, NCK1, MARCKS AAK1 1/4885CYP3A4 4488/4885PRKG2 886/4885
US-20250262197-A1 COMPOUNDS AND METHODS FOR TREATING CHEMOTHERAPY-INDUCED PAIN PNCK, CAMKK1, CAMK2G AAK1 33/4885CYP3A4 4844/4885PRKG2 92/4885
US-20240360131-A1 BIARYL KINASE INHIBITORS AAK1, NCK1, MARCKS AAK1 1/4885CYP3A4 4488/4885PRKG2 886/4885

“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.

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