SCHEMBL1743682

SCHEMBL1743682

Nc1c(NCCNC(=O)O)ccnc1Cl

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.38
NR4A2 P43354 1/20 0.38
KMT2A Q03164 3/20 0.37
CYP1A2 P05177 1/20 0.37
FERMT2 Q96AC1 3/20 0.35
HTR1A P08908 4/20 0.35
ADRA1D P25100 4/20 0.35
ADRA1A P35348 4/20 0.35
ADRA1B P35368 4/20 0.35
SHMT2 P34897 1/20 0.35
HRH4 Q9H3N8 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
GALR3 O60755 1/20 0.33

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
SCHEMBL13242138 0.78 CYP1A2 (0.41) CYP1A2FERMT2HTR1AADRA1DADRA1A
SCHEMBL1742858 0.78 MAPT (0.39) BACE1NR4A2KMT2ACYP1A2RAB9A
SCHEMBL1742856 0.78 MAPT (0.39) BACE1NR4A2KMT2ACYP1A2RAB9A
SCHEMBL14031588 0.74 TLR8 (0.50) NR4A2FERMT2KDM4CRAB9ASMN1; SMN2
SCHEMBL3448086 0.73 AOC1 (0.38) CYP1A2FERMT2KDM4CRAB9AALDH1A1
SCHEMBL8666897 0.71 BACE1 (0.55) BACE1KMT2ACYP1A2KDM4CALDH1A1
SCHEMBL30482461 0.71 BACE1 (0.33) BACE1NR4A2KMT2AHRH4KDM4C
SCHEMBL30148167 0.71 CCR1 (0.38) NR4A2CYP1A2FERMT2HTR1AADRA1D
SCHEMBL4005235 0.71 CCR1 (0.38) NR4A2CYP1A2FERMT2HTR1AADRA1D
SCHEMBL3909900 0.70 ALDH1A1 (0.47) CYP1A2HRH4ALDH1A1

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192687-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2023-06-22 US disclosed
US-11560377-B2 Fused amino pyridine as HSP90 inhibitors Guris, Inc. (US) 2023-01-24 US disclosed
US-20210292317-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2021-09-23 US disclosed
US-10844056-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2020-11-24 US disclosed
US-20200062754-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2020-02-27 US disclosed
US-10428068-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2019-10-01 US disclosed
US-20190010152-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2019-01-10 US disclosed
US-10035797-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2018-07-31 US disclosed
US-20170267674-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2017-09-21 US disclosed
US-9630965-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2017-04-25 US disclosed
US-8586605-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2013-11-19 US disclosed
EP-2069324-B1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS INC (US) 2013-07-31 EP disclosed
US-8324240-B2 Fused amino pyridine as HSP90 inhibitors CURIS, INC. (US) 2012-12-04 US disclosed
US-20120237508-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS, INC. 2012-09-20 US disclosed
EP-2387316-A1 FUSED AMINO PYRIDINES FOR THE TREATMENT OF BRAIN TUMORS Curis, Inc. (US) 2011-11-23 EP disclosed
US-20100184801-A1 FUSED AMINO PYRIDINES FOR THE TREATMENT OF BRAIN TUMORS CURIS, INC. 2010-07-22 US disclosed
WO-2010083403-A1 FUSED AMINO PYRIDINES FOR THE TREATMENT OF BRAIN TUMORS CURIS, INC. (US) 2010-07-22 WO disclosed
EP-2069324-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS Curis, Inc. (US) 2009-06-17 EP disclosed
WO-2008115719-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS, INC. (US) 2008-09-25 WO disclosed
US-20080234314-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS CURIS, INC. 2008-09-25 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 (12 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-20190010152-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-10428068-B2 Fused amino pyridine as HSP90 inhibitors HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-20170267674-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-20120237508-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-20230192687-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-20080234314-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-20100184801-A1 FUSED AMINO PYRIDINES FOR THE TREATMENT OF BRAIN TUMORS IDH2, IDH1, AADAT BACE1 2892/4885NR4A2 1753/4885KMT2A 811/4885
US-20210292317-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-20200062754-A1 FUSED AMINO PYRIDINE AS HSP90 INHIBITORS HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-11560377-B2 Fused amino pyridine as HSP90 inhibitors HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-10844056-B2 Fused amino pyridine as HSP90 inhibitors HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885
US-10035797-B2 Fused amino pyridine as HSP90 inhibitors HSP90B1, HSP90AB1, HSP90AB2P BACE1 4377/4885NR4A2 1765/4885KMT2A 3163/4885

“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.