SCHEMBL12484356

SCHEMBL12484356

CCCc1cc(N2CC[C@H](NC(=O)OC(C)(C)C)C2)nc(Cl)n1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 2/20 0.51
▸ JAK3 P52333 1/20 0.51
▸ SUV39H2 Q9H5I1 15/20 0.50
▸ CKS1B P61024 1/20 0.46
▸ SKP1 P63208 1/20 0.46
▸ SKP2 Q13309 1/20 0.46
▸ PDE10A Q9Y233 1/20 0.44
▸ AURKA O14965 1/20 0.44
▸ PDPK1 O15530 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44

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
SCHEMBL12484351 1.00 BTK (0.51) BTKJAK3SUV39H2CKS1BSKP1
SCHEMBL12486601 0.94 JAK3 (0.58) BTKJAK3SUV39H2PDE10AAURKA
SCHEMBL12486599 0.94 JAK3 (0.58) BTKJAK3SUV39H2PDE10AAURKA
SCHEMBL28806059 0.89 JAK3 (0.56) BTKJAK3SUV39H2PDE10AAURKA
SCHEMBL12483304 0.86 HRH4 (0.47) SUV39H2CKS1BSKP1SKP2
SCHEMBL17745731 0.86 HRH4 (0.47) SUV39H2
SCHEMBL12485863 0.86 HRH4 (0.47) SUV39H2CKS1BSKP1SKP2
SCHEMBL24851725 0.85 BTK (0.57) BTKJAK3SUV39H2CKS1BSKP1
SCHEMBL31539345 0.85 BTK (0.55) BTKJAK3SUV39H2CKS1BSKP1
SCHEMBL31518429 0.85 BTK (0.55) BTKJAK3SUV39H2CKS1BSKP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10227330-B2 Diaminopyrimidine derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2019-03-12 — — US disclosed
US-20180111918-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2018-04-26 — — US disclosed
US-9890138-B2 Diaminopyrimidine derivatives and processes for the preparation thereof YUHAN CORPORATION (KR) 2018-02-13 — — US disclosed
EP-2678332-B1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORP (KR) 2016-05-18 — — EP disclosed
US-20150274700-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2015-10-01 — — US disclosed
EP-2678332-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF Yuhan Corporation (KR) 2014-01-01 — — EP disclosed
US-20130338179-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2013-12-19 — — US disclosed
WO-2012115480-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF YUHAN CORPORATION (KR) 2012-08-30 — — 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 (4 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-20150274700-A2 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF HRH2, GIPR, SSTR4 BTK 4572/4885JAK3 1012/4885SUV39H2 3829/4885
US-20130338179-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF HRH2, GIPR, SSTR4 BTK 4572/4885JAK3 1012/4885SUV39H2 3829/4885
US-20180111918-A1 DIAMINOPYRIMIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF HRH2, GIPR, SSTR4 BTK 4572/4885JAK3 1012/4885SUV39H2 3829/4885
US-10227330-B2 Diaminopyrimidine derivatives and processes for the preparation thereof HRH2, GIPR, SSTR4 BTK 4572/4885JAK3 1012/4885SUV39H2 3829/4885

“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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