SCHEMBL4978243

SCHEMBL4978243

Cc1ccc(Nc2nccc(NCc3ccc4c(c3)nc(NC(C)C)n4C)n2)cc1S(N)(=O)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 1/20 0.51
▸ CSF1R P07333 5/20 0.43
▸ TYK2 P29597 4/20 0.43
▸ KDR P35968 3/20 0.42
▸ JAK2 O60674 3/20 0.42
▸ JAK3 P52333 3/20 0.42
▸ LYN P07948 3/20 0.42
▸ SYK P43405 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2D6 P10635 2/20 0.42
▸ CYP2C9 P11712 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ TXK P42681 2/20 0.42
▸ PLK4 O00444 2/20 0.42
▸ AURKA O14965 2/20 0.42
▸ MAP4K4 O95819 2/20 0.42
▸ LCK P06239 2/20 0.42
▸ FYN P06241 2/20 0.42
▸ RET P07949 2/20 0.42
▸ ROS1 P08922 2/20 0.42

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
Hydrochloric Acid SCHEMBL4979291 0.99 BTK (0.50) BTKCSF1RTYK2KDRJAK2
SCHEMBL4976707 0.89 BTK (0.51) BTKCSF1RTYK2KDRJAK2
SCHEMBL4981895 0.88 BTK (0.50) BTKCSF1RTYK2KDRJAK2
SCHEMBL4982197 0.88 BTK (0.50) BTKCSF1RTYK2KDRJAK2
SCHEMBL4980837 0.88 BTK (0.50) BTKCSF1RTYK2KDRJAK2
Hydrochloric Acid SCHEMBL4976684 0.88 BTK (0.50) BTKCSF1RTYK2KDRJAK2
Hydrochloric Acid SCHEMBL4980298 0.87 BTK (0.49) BTKCSF1RTYK2KDRJAK2
SCHEMBL4977020 0.87 BTK (0.49) BTKCSF1RTYK2KDRJAK2
Hydrochloric Acid SCHEMBL4980031 0.87 BTK (0.49) BTKCSF1RTYK2KDRJAK2
SCHEMBL4978576 0.87 BTK (0.47) BTKCSF1RTYK2KDRJAK2

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
US-7338959-B2 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-03-04 — — US claimed
US-20050234083-A1 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION 2005-10-20 — — US claimed
US-7338959-B2 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2008-03-04 — — US disclosed
US-20050234083-A1 Diamino-pyrimidines and their use as angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION 2005-10-20 — — 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 (1 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-20050234083-A1 Diamino-pyrimidines and their use as angiogenesis inhibitors TIE1, TEK, KDR BTK 895/4885CSF1R 501/4885TYK2 451/4885

“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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