SCHEMBL19544600

SCHEMBL19544600

CCOC(=O)c1c(C#N)c(-c2ccc(OC3CC3)cc2)nn1[C@@H]1CCCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 9/20 0.51
▸ GPR119 Q8TDV5 3/20 0.45
▸ CHEK2 O96017 3/20 0.42
▸ HPGD P15428 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 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
SCHEMBL19624818 1.00 BTK (0.51) BTKGPR119CHEK2HPGDKDM4E
SCHEMBL19544682 0.95 BTK (0.48) BTKGPR119CHEK2HPGDKDM4E
SCHEMBL19544905 0.94 BTK (0.49) BTKGPR119CHEK2
SCHEMBL19624659 0.94 BTK (0.47) BTKGPR119CHEK2HPGDKDM4E
SCHEMBL19544647 0.91 BTK (0.55) BTK
SCHEMBL19544659 0.91 BTK (0.55) BTK
SCHEMBL25060355 0.90 BTK (0.48) BTKGPR119CHEK2ALDH1A1
SCHEMBL19544304 0.90 BTK (0.48) BTKGPR119CHEK2ALDH1A1
SCHEMBL19624846 0.90 CHEK2 (0.45) BTKGPR119CHEK2HPGDKDM4E
SCHEMBL19544728 0.89 BTK (0.54) BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246317-B1 BTK INHIBITOR HUBEI BIO PHARMACEUTICAL INDUSTRIAL TECH INSTITUTE INC (CN) 2023-02-22 — — EP disclosed
US-10662174-B2 BTK inhibitor HUBEI BIO-PHARMACEUTICAL INDUSTRIAL TECHNOLOGICAL INSTITUTE, INC. (CN) 2020-05-26 — — US disclosed
EP-3246317-A1 BTK INHIBITOR Hubei Bio-Pharmaceutical Industrial Technological Institute Inc. (CN) 2017-11-22 — — EP disclosed
US-20170313683-A1 BTK INHIBITOR HUBEI BIO-PHARMACEUTICAL INDUSTRIAL TECHNOLOGICAL INSTITUTE, INC. (CN) 2017-11-02 — — 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 (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-10662174-B2 BTK inhibitor BTK, SYK, LYN BTK 1/4885GPR119 2179/4885CHEK2 333/4885
US-20170313683-A1 BTK INHIBITOR BTK, SYK, LYN BTK 1/4885GPR119 2179/4885CHEK2 333/4885

“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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