SCHEMBL2564150

SCHEMBL2564150

CC1(C)C=Cc2cc(CNC3CCCCC3)ncc2O1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.49
EPAS1 Q99814 8/20 0.49
HTR2A P28223 1/20 0.37
USP2 O75604 1/20 0.35
PABPC1 P11940 1/20 0.34
CXCR4 P61073 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KCNH2 Q12809 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
SCHEMBL2562807 0.77 KDM4E (0.34) HIF1AEPAS1USP2PABPC1KDM4E
SCHEMBL15052201 0.77 HIF1A (0.53) HIF1AEPAS1HTR2AHTT
SCHEMBL2564066 0.76 ALDH1A1 (0.38) HIF1AEPAS1USP2PABPC1CXCR4
SCHEMBL15052336 0.74 HIF1A (0.53) HIF1AEPAS1HTR2AHTT
SCHEMBL15760106 0.71 KCNH2 (0.50) KCNH2
SCHEMBL15052753 0.71 HIF1A (0.55) HIF1AEPAS1HTR2AHTT
SCHEMBL30814161 0.71 HIF1A (0.48) HIF1AEPAS1KCNH2
SCHEMBL25044370 0.64 KDM1A (0.55) USP2PABPC1KDM4EMEN1KMT2A
SCHEMBL26021280 0.64 CXCR4 (0.51) USP2PABPC1CXCR4KDM4EKMT2A
SCHEMBL22146132 0.61 KCNH2 (0.43) KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9062072-B2 Inhibitors of HIF and angiogenesis EMORY UNIVERSITY (US) 2015-06-23 US disclosed
US-20130116275-A1 INHIBITORS OF HIF AND ANGIOGENESIS GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION (US) 2013-05-09 US disclosed
WO-2011133659-A2 INHIBITORS OF HIF AND ANGIOGENESIS EMORY UNIVERSITY (US) 2011-10-27 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 (1 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-20130116275-A1 INHIBITORS OF HIF AND ANGIOGENESIS HIF1AN, HIF1A, EGLN2 HIF1A 2/4885EPAS1 16/4885HTR2A 2962/4885

“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.