SCHEMBL10859620

SCHEMBL10859620

Nc1cccc(C(=O)NCCCn2ccnc2)c1

nearest known ligand 0.75

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.75
MEN1 O00255 2/20 0.75
SMN1; SMN2 Q16637 3/20 0.67
NPC1 O15118 1/20 0.67
RXFP1 Q9HBX9 1/20 0.64
POLB P06746 1/20 0.62
ALOX15 P16050 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
LMNA P02545 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
NAMPT P43490 3/20 0.60
GAA P10253 1/20 0.59
ALDH1A1 P00352 2/20 0.58
CYP19A1 P11511 1/20 0.58
MAPT P10636 1/20 0.58
TSHR P16473 1/20 0.58

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
SCHEMBL15084278 0.88 SMN1; SMN2 (0.70) KMT2AMEN1SMN1; SMN2NPC1POLB
SCHEMBL16869708 0.86 KMT2A (0.75) KMT2AMEN1SMN1; SMN2NPC1RXFP1
SCHEMBL10853932 0.86 MEN1 (1.00) KMT2AMEN1SMN1; SMN2NPC1RXFP1
SCHEMBL5257694 0.85 SMN1; SMN2 (0.78) KMT2AMEN1SMN1; SMN2NPC1POLB
SCHEMBL1775216 0.85 SMN1; SMN2 (0.82) KMT2AMEN1SMN1; SMN2NPC1POLB
SCHEMBL27176246 0.85 MEN1 (0.73) KMT2AMEN1SMN1; SMN2NPC1RXFP1
SCHEMBL30087224 0.85 MEN1 (0.73) KMT2AMEN1SMN1; SMN2NPC1RXFP1
SCHEMBL14375139 0.84 KMT2A (0.72) KMT2AMEN1SMN1; SMN2NPC1RXFP1
SCHEMBL17550818 0.83 KMT2A (0.71) KMT2AMEN1SMN1; SMN2NPC1RXFP1
SCHEMBL21098369 0.83 SMN1; SMN2 (0.89) KMT2AMEN1SMN1; SMN2NPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170239259-A1 ARYLOXY PHENOXY ACRYLIC COMPOUND HAVING HIF-1 INHIBITION ACTIVITY, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS AN ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2017-08-24 US disclosed
US-8940936-B2 Aryloxy phenoxy acrylic compound having HIF-1 inhibition activity, method for preparing same, and pharmaceutical composition containing same as an active ingredient KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2015-01-27 US disclosed
US-20130237542-A1 ARYLOXY PHENOXY ACRYLIC COMPOUND HAVING HIF-1 INHIBITION ACTIVITY, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS AN ACTIVE INGREDIENT DONGGUK UNIVERSITY INDUSTRY-ACADEMIC COOPERATION FOUNDATION (KR) 2013-09-12 US disclosed
WO-2007038669-A9 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC 2008-05-29 WO disclosed
WO-2007038669-A2 DIARYLAMINE-CONTAINING COMPOUNDS AND COMPOSITIONS, AND THEIR USE AS MODULATORS OF C-KIT RECEPTORS IRM LLC (BM) 2007-04-05 WO disclosed
US-4568687-A THROMBOXANE SYNTHETASE TNZYME INHIBITORS; HYPOTENSIVE AGENTS, CARDIOTONIC AGENTS AMERICAN CYANAMID COMPANY (US) 1986-02-04 US disclosed
EP-0117462-A2 N-(2-4-(1H-imidazol-1-yl)alkyl)arylamides AMERICAN CYANAMID COMPANY (US) 1984-09-05 EP 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-20130237542-A1 ARYLOXY PHENOXY ACRYLIC COMPOUND HAVING HIF-1 INHIBITION ACTIVITY, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS AN ACTIVE INGREDIENT HIF1A, HIF1AN, VHL KMT2A 628/4885MEN1 3882/4885SMN1; SMN2 2399/4885
US-20170239259-A1 ARYLOXY PHENOXY ACRYLIC COMPOUND HAVING HIF-1 INHIBITION ACTIVITY, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS AN ACTIVE INGREDIENT HIF1A, HIF1AN, VHL KMT2A 628/4885MEN1 3882/4885SMN1; SMN2 2399/4885

“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.