SCHEMBL2843359

SCHEMBL2843359

Cc1cn(-c2cc(CC(=O)Nc3ccc(Oc4ncnc5[nH]cnc45)cc3)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NR2E1 Q9Y466 14/20 0.55
▸ PSEN1 P49768 2/20 0.53
▸ PSEN2 P49810 2/20 0.53
▸ APH1B Q8WW43 2/20 0.53
▸ NCSTN Q92542 2/20 0.53
▸ APH1A Q96BI3 2/20 0.53
▸ PSENEN Q9NZ42 2/20 0.53
▸ KDR P35968 1/20 0.44
▸ LDLR P01130 1/20 0.44
▸ KIT P10721 1/20 0.44
▸ PCSK9 Q8NBP7 1/20 0.44
▸ RET P07949 1/20 0.44
▸ CYP2D6 P10635 1/20 0.43
▸ CSF1R P07333 1/20 0.42
▸ PDGFRB P09619 1/20 0.42
▸ PDGFRA P16234 1/20 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
SCHEMBL12975650 0.88 NR2E1 (0.55) NR2E1PSEN1PSEN2APH1BNCSTN
SCHEMBL2840607 0.88 KDR (0.56) NR2E1KDRLDLRKITPCSK9
SCHEMBL3253663 0.82 PSEN1 (0.45) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL12999021 0.81 KDR (0.43) NR2E1KDRLDLRKITPCSK9
SCHEMBL12999017 0.78 MET (0.47) NR2E1PSEN1PSEN2APH1BNCSTN
SCHEMBL2845565 0.75 KDR (0.66) NR2E1KDRLDLRKITPCSK9
SCHEMBL13679856 0.75 MAPK14 (0.45) NR2E1PSEN1PSEN2APH1BNCSTN
SCHEMBL2847430 0.74 MAP4K2 (0.58) NR2E1KDRLDLRKITPCSK9
SCHEMBL31729822 0.72 NR2E1 (1.00) NR2E1LDLRKITPCSK9
SCHEMBL31718472 0.71 NR2E1 (0.61) NR2E1PSEN1PSEN2APH1BNCSTN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8592433-B2 Compounds and compositions as protein kinase inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2013-11-26 — — US claimed
US-20100324062-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-12-23 — — US claimed
US-20100130476-A1 COMPOUNDS THAT INDUCE PANCREATIC BETA-CELL EXPANSION THE SCRIPPS RESEARCH INSTITUTE (US) 2010-05-27 — — US claimed
EP-1940844-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-09-30 — — EP claimed
US-8592433-B2 Compounds and compositions as protein kinase inhibitors NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2013-11-26 — — US disclosed
US-20100324062-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-12-23 — — US disclosed
US-20100130476-A1 COMPOUNDS THAT INDUCE PANCREATIC BETA-CELL EXPANSION THE SCRIPPS RESEARCH INSTITUTE (US) 2010-05-27 — — US disclosed
WO-2010056907-A2 COMPOUNDS THAT INDUCE PANCREATIC BETA-CELL EXPANSION THE SCRIPPS RESEARCH INSTITUTE (US) 2010-05-20 — — WO disclosed
EP-1940844-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-09-30 — — EP 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-20100324062-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS SYK, SRC, FYN NR2E1 1653/4885PSEN1 3331/4885PSEN2 2143/4885
US-20100130476-A1 COMPOUNDS THAT INDUCE PANCREATIC BETA-CELL EXPANSION IAPP, PNLIP, GPR119 NR2E1 843/4885PSEN1 486/4885PSEN2 891/4885

“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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