SCHEMBL1931638

SCHEMBL1931638

COc1ccc(Cc2nnc(N[C@H]3CO[C@H](C(C)C)OC3)c3ccccc23)cn1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 13/20 0.41
▸ KDM1A O60341 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ MAOB P27338 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ SHMT2 P34897 1/20 0.36
▸ PDGFRB P09619 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ FLT1 P17948 1/20 0.35
▸ CHRNA7 P36544 1/20 0.34

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
SCHEMBL1930868 0.87 KDR (0.35) KDRMEN1KMT2APDGFRBKIT
SCHEMBL4680006 0.87 KDR (0.35) KDRMEN1KMT2APDGFRBKIT
SCHEMBL1929839 0.85 KDR (0.42) KDRKDM1AMAOAMAOBMEN1
SCHEMBL4834682 0.72 CYP11B1 (0.31) —
SCHEMBL4679265 0.71 KDM4E (0.40) KDRMEN1KMT2APDGFRBKIT
SCHEMBL1931665 0.71 KDM4E (0.40) KDRMEN1KMT2APDGFRBKIT
SCHEMBL1930677 0.70 SHMT2 (0.42) KDRMEN1KMT2ASHMT2PDGFRB
SCHEMBL4740445 0.70 KDR (0.33) KDRMEN1KMT2APDGFRBKIT
SCHEMBL4740449 0.70 KDR (0.33) KDRMEN1KMT2APDGFRBKIT
SCHEMBL1931675 0.70 KDR (0.44) KDRKDM1AMAOAMAOBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034814-B2 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2011-10-11 — — US disclosed
US-20110130399-A1 Phthalazine Derivatives with Angiogenesis Inhibiting Activity NOVARTIS AG (CH) 2011-06-02 — — US disclosed
US-20090076003-A1 Phthalazine Derivatives with Angiogenesis Inhibiting Activity NOVARTIS AG 2009-03-19 — — US disclosed
US-7399761-B2 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2008-07-15 — — US disclosed
EP-1387836-B1 PHTHALAZINE DERIVATIVES WITH ANGIOGENESIS INHIBITING ACTIVITY NOVARTIS AG (CH) 2008-04-23 — — EP disclosed
US-20040180899-A1 Phthalazine derivatives with angiogenesis inhibiting activity NOVARTIS AG (CH) 2004-09-16 — — 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-20090076003-A1 Phthalazine Derivatives with Angiogenesis Inhibiting Activity KDR, FLT1, FLT4 KDR 1/4885KDM1A 2712/4885MAOA 2064/4885
US-20110130399-A1 Phthalazine Derivatives with Angiogenesis Inhibiting Activity KDR, FLT1, FLT4 KDR 1/4885KDM1A 2602/4885MAOA 2549/4885
US-20040180899-A1 Phthalazine derivatives with angiogenesis inhibiting activity VEGFA, NR5A1, PGF KDR 13/4885KDM1A 2096/4885MAOA 120/4885

“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.

Send feedback