SCHEMBL30086609

SCHEMBL30086609

Cc1cccc(-c2nccc(Nc3ccnc(Nc4ccc(CN5CCOCC5)c(F)c4)n3)n2)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 2/20 0.44
▸ JAK2 O60674 5/20 0.44
▸ JAK3 P52333 4/20 0.44
▸ CSF1R P07333 1/20 0.43
▸ TYK2 P29597 1/20 0.43
▸ ULK2 Q8IYT8 1/20 0.43
▸ TBK1 Q9UHD2 1/20 0.43
▸ BMPR1B O00238 1/20 0.42
▸ NUAK1 O60285 1/20 0.42
▸ ACVR1 Q04771 1/20 0.42
▸ SIK2 Q9H0K1 1/20 0.42
▸ PLK4 O00444 2/20 0.42
▸ CYP1A2 P05177 1/20 0.40
▸ ABL1 P00519 2/20 0.40
▸ BCR P11274 2/20 0.40
▸ LYN P07948 1/20 0.40
▸ EGFR P00533 1/20 0.40
▸ PLK1 P53350 1/20 0.40
▸ AURKA O14965 2/20 0.39
▸ AURKB Q96GD4 2/20 0.39

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
SCHEMBL23906911 1.00 IGF1R (0.44) IGF1RJAK2JAK3CSF1RTYK2
SCHEMBL23906834 0.87 CSF1R (0.56) IGF1RJAK2JAK3CSF1RTYK2
SCHEMBL30086528 0.87 CSF1R (0.56) IGF1RJAK2JAK3CSF1RTYK2
SCHEMBL30086676 0.87 JAK2 (0.52) IGF1RJAK2JAK3CSF1RTYK2
SCHEMBL23906681 0.87 JAK2 (0.52) IGF1RJAK2JAK3CSF1RTYK2
SCHEMBL23906917 0.86 JAK2 (0.51) IGF1RJAK2JAK3CSF1RTYK2
SCHEMBL30086450 0.86 JAK2 (0.51) IGF1RJAK2JAK3CSF1RTYK2
SCHEMBL30086809 0.85 JAK2 (0.46) JAK2JAK3ABL1BCRLYN
SCHEMBL23906914 0.85 JAK2 (0.46) JAK2JAK3ABL1BCRLYN
SCHEMBL23906828 0.84 IKBKB (0.39) JAK2JAK3ACVR1PLK4ABL1

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 3 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-11673879-B2 Substituted pyrimidines and methods of use THERAVANCE BIOPHARMA R&D IP, LLC (US) 2023-06-13 — — US disclosed
US-20220372015-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-11-24 — — 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 (3 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-20220372015-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE ALK, TYMP, ENTPD5 IGF1R 558/4885JAK2 1187/4885JAK3 1474/4885
US-11673879-B2 Substituted pyrimidines and methods of use ALK, TYMP, ENTPD5 IGF1R 558/4885JAK2 1187/4885JAK3 1474/4885
US-20230399312-A1 SUBSTITUTED PYRIMIDINES AND METHODS OF USE ALK, TYMP, ENTPD5 IGF1R 558/4885JAK2 1187/4885JAK3 1474/4885

“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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