SCHEMBL3038486

SCHEMBL3038486

Cc1cc(Nc2nc(Br)cn3ccnc23)n[nH]1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 9/20 0.42
▸ FGFR1 P11362 6/20 0.42
▸ KDR P35968 6/20 0.42
▸ INSR P06213 3/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HTR2C P28335 1/20 0.40
▸ PLK4 O00444 1/20 0.38
▸ PAK4 O96013 1/20 0.38
▸ ITK Q08881 1/20 0.38
▸ JAK2 O60674 1/20 0.38
▸ JAK3 P52333 1/20 0.38
▸ AURKA O14965 1/20 0.37
▸ AURKB Q96GD4 1/20 0.37

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
SCHEMBL3040346 0.80 AURKA (0.54) IGF1RITKAURKAAURKB
SCHEMBL3028147 0.79 IGF1R (0.52) IGF1RMEN1HTTKMT2AHSD17B10
SCHEMBL2273731 0.73 HTR2C (0.47) L3MBTL1HTR2CAURKA
SCHEMBL26222591 0.73 AURKA (0.50) IGF1RFGFR1KDRINSRMEN1
SCHEMBL19865160 0.71 L3MBTL1 (0.53) L3MBTL1HTR2C
SCHEMBL24864096 0.71 CYP1A2 (0.40) L3MBTL1HTR2CAURKA
SCHEMBL2221438 0.70 AURKA (0.60) IGF1RHTR2CAURKA
SCHEMBL15956956 0.70 AURKA (0.50) HTR2CAURKA
SCHEMBL23889412 0.70 MEN1 (0.41) IGF1RFGFR1KDRMEN1HTT
SCHEMBL2271526 0.70 HTR2C (0.43) KDRL3MBTL1HTR2CAURKA

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-8288536-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-16 — — US disclosed
US-20100216765-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 — — US disclosed
US-7713973-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-11 — — US disclosed
EP-1812439-A2 KINASE INHIBITORS Takeda San Diego, Inc. (US) 2007-08-01 — — EP disclosed
WO-2006044687-A2 KINASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2006-04-27 — — WO disclosed
US-20060084650-A1 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-04-20 — — 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 (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-20060084650-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 IGF1R 787/4885FGFR1 610/4885KDR 492/4885
US-20100216765-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 IGF1R 787/4885FGFR1 610/4885KDR 492/4885

“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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