SCHEMBL2564356

SCHEMBL2564356

CC1(C)C=Cc2cc(CNc3ccccc3)cnc2O1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 6/20 0.49
EPAS1 Q99814 6/20 0.49
LTA4H P09960 1/20 0.38
CYP1A2 P05177 2/20 0.36
PDGFRB P09619 1/20 0.35
PDGFRA P16234 1/20 0.35
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL14930303 0.81 HIF1A (0.42) HIF1AEPAS1
SCHEMBL2561679 0.78 HIF1A (0.68) HIF1AEPAS1
SCHEMBL2564127 0.75 HIF1A (0.49) HIF1AEPAS1
SCHEMBL2564066 0.73 ALDH1A1 (0.38) HIF1AEPAS1MEN1KMT2A
SCHEMBL14178660 0.70 HIF1A (0.63) HIF1AEPAS1
SCHEMBL2564022 0.68 HIF1A (0.38) HIF1AEPAS1CYP1A2MEN1CYP3A4
SCHEMBL2628506 0.68 HIF1A (0.36) HIF1AEPAS1CYP3A4
SCHEMBL31149387 0.68 HIF1A (0.36) HIF1AEPAS1CYP3A4
SCHEMBL8117447 0.68 HIF1A (0.36) HIF1AEPAS1CYP3A4
SCHEMBL2557901 0.68 HIF1A (0.52) HIF1AEPAS1CYP1A2MEN1CYP3A4

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 16/4885LTA4H 2301/4885

“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.