SCHEMBL14142148

SCHEMBL14142148

COCOCCN1CCN(c2cc(Nc3nc(C(C)C)c(C(=O)O)s3)nc(C)n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 6/20 0.46
▸ ABL1 P00519 10/20 0.44
▸ FLT3 P36888 7/20 0.44
▸ KIT P10721 6/20 0.44
▸ SIK2 Q9H0K1 7/20 0.43
▸ SIK3 Q9Y2K2 7/20 0.43
▸ SIK1 P57059 6/20 0.43
▸ AURKA O14965 1/20 0.41
▸ PKMYT1 Q99640 1/20 0.41

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
SCHEMBL14141953 0.90 ABL1 (0.47) SRCABL1FLT3KITSIK2
SCHEMBL14141864 0.89 SRC (0.46) SRCABL1FLT3KITSIK2
SCHEMBL14142178 0.88 SRC (0.47) SRCABL1FLT3KITSIK2
SCHEMBL14141795 0.88 FLT3 (0.50) SRCABL1FLT3KITSIK2
SCHEMBL14141851 0.88 SRC (0.45) SRCABL1FLT3KITSIK2
SCHEMBL14142048 0.87 SRC (0.60) SRCABL1FLT3KITSIK2
SCHEMBL14141994 0.86 SRC (0.46) SRCABL1FLT3KITSIK2
SCHEMBL14142537 0.85 SRC (0.52) SRCABL1FLT3KITSIK2
SCHEMBL14141782 0.82 ABL1 (0.59) SRCABL1FLT3KITSIK2
SCHEMBL14141952 0.80 ABL1 (0.59) SRCABL1FLT3KITSIK2

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-9108954-B2 Synthesis process of dasatinib and intermediate thereof NAN JING CAVENDISH BIO-ENGINEERING TECHNOLOGY CO., LTD. (CN) 2015-08-18 — — US claimed
US-20130030177-A1 SYNTHESIS PROCESS OF DASATINIB AND INTERMEDIATE THEREOF Nan Jing Cavendish Bio-Engineering Technology Co. Ltd. (CN) 2013-01-31 — — US claimed
EP-2532662-A1 SYNTHESIS PROCESS OF DASATINIB AND INTERMEDIATE THEREOF Nanjing Cavendish Bio-Engineering Technology Co., Ltd. (CN) 2012-12-12 — — EP claimed
US-9108954-B2 Synthesis process of dasatinib and intermediate thereof NAN JING CAVENDISH BIO-ENGINEERING TECHNOLOGY CO., LTD. (CN) 2015-08-18 — — US disclosed
US-20130030177-A1 SYNTHESIS PROCESS OF DASATINIB AND INTERMEDIATE THEREOF Nan Jing Cavendish Bio-Engineering Technology Co. Ltd. (CN) 2013-01-31 — — 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-20130030177-A1 SYNTHESIS PROCESS OF DASATINIB AND INTERMEDIATE THEREOF ABL1, YES1, ABL2 SRC 8/4885ABL1 1/4885FLT3 4/4885

“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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