SCHEMBL23906595

SCHEMBL23906595

Cc1cccc(-c2nccc(Nc3ccnc(Nc4cccc(N5CCN(C)CC5)c4)n3)n2)n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 6/20 0.61
▸ JAK3 P52333 4/20 0.61
▸ EGFR P00533 3/20 0.61
▸ CDK2 P24941 7/20 0.53
▸ FLT3 P36888 4/20 0.53
▸ CDK1 P06493 3/20 0.53
▸ CCNB1 P14635 3/20 0.53
▸ CDK7 P50613 3/20 0.53
▸ CCNH P51946 3/20 0.53
▸ CCNE1 P24864 2/20 0.53
▸ MNAT1 P51948 1/20 0.53
▸ BRD4 O60885 1/20 0.48
▸ KIT P10721 2/20 0.47
▸ PLK4 O00444 1/20 0.47
▸ CHEK1 O14757 1/20 0.47
▸ PRKD3 O94806 1/20 0.47
▸ LCK P06239 1/20 0.47
▸ CSF1R P07333 1/20 0.47
▸ ROS1 P08922 1/20 0.47
▸ FGFR1 P11362 1/20 0.47

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
SCHEMBL30086477 1.00 JAK2 (0.61) JAK2JAK3EGFRCDK2FLT3
SCHEMBL23906886 0.90 JAK2 (0.66) JAK2JAK3EGFRCDK2CCNE1
SCHEMBL30086423 0.90 JAK2 (0.66) JAK2JAK3EGFRCDK2CCNE1
SCHEMBL30086420 0.90 CAMK2D (0.53) JAK2JAK3EGFRCDK2FLT3
SCHEMBL25263571 0.90 CAMK2D (0.53) JAK2JAK3EGFRCDK2FLT3
SCHEMBL23906530 0.88 CDK2 (0.57) JAK2JAK3EGFRCDK2FLT3
SCHEMBL30086561 0.88 CDK2 (0.57) JAK2JAK3EGFRCDK2FLT3
SCHEMBL23906844 0.85 JAK2 (0.64) JAK2JAK3EGFRCDK2CCNE1
SCHEMBL30086365 0.85 JAK2 (0.64) JAK2JAK3EGFRCDK2CCNE1
SCHEMBL23906670 0.85 CCND3 (0.52) JAK2JAK3EGFRCDK2CDK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230399312-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-12-14 — — US disclosed
US-20230399312-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP LLC (US) 2023-12-14 — — US disclosed
US-11673879-B2 Substituted pyrimidines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-06-13 — — US disclosed
US-11673879-B2 Substituted pyrimidines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-06-13 — — US disclosed
WO-2021203131-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-10-07 — — 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-11673879-B2 Substituted pyrimidines and methods of use ALK, TYMP, ENTPD5 JAK2 1187/4885JAK3 1474/4885EGFR 545/4885
US-20230399312-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE ALK, TYMP, ENTPD5 JAK2 1187/4885JAK3 1474/4885EGFR 545/4885

“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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