SCHEMBL4514601

SCHEMBL4514601

COC(=O)c1cc(C(=O)c2nc(NC(=O)c3cccc(OCCCCCCCCOc4cccc(C(=O)Nc5nc(C(=O)c6ccc(N)c(C(=O)OC)c6)n6ccccc56)c4)c3)c3ccccn23)ccc1N

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NR1H4 Q96RI1 3/20 0.37
HRH3 Q9Y5N1 1/20 0.37
TP53 P04637 2/20 0.36
NPC1 O15118 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLB P06746 1/20 0.36
THRB P10828 1/20 0.36
LMNA P02545 1/20 0.35
CYSLTR1 Q9Y271 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
SCHEMBL4504643 0.92 NR1H4 (0.40) SMPD1MEN1KMT2ANR1H4HRH3
SCHEMBL4506386 0.83 KMT2A (0.43) SMPD1MEN1KMT2ANR1H4TP53
SCHEMBL4496429 0.81 KMT2A (0.44) MEN1KMT2ANR1H4TP53NPC1
SCHEMBL4508885 0.81 ALDH1A1 (0.40) MEN1KMT2ATP53NPC1HTT
SCHEMBL1932569 0.81 KMT2A (0.46) MEN1KMT2ATP53NPC1HTT
SCHEMBL13918698 0.81 ALDH1A1 (0.39) MEN1KMT2ATP53NPC1RAB9A
SCHEMBL4502430 0.80 NR1H4 (0.42) SMPD1KMT2ANR1H4
SCHEMBL13918694 0.79 ALDH1A1 (0.38) MEN1KMT2ASMN1; SMN2HSD17B10
SCHEMBL4507260 0.77 MAPT (0.38) MEN1KMT2ATP53NPC1RAB9A
SCHEMBL4503884 0.77 DAPK3 (0.47) MEN1KMT2ANPC1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9120819-B2 FGF-receptor agonist dimeric compounds SANOFI (FR) 2015-09-01 US disclosed
US-20090069368-A1 FGF-RECEPTOR AGONIST DIMERIC COMPOUNDS SANOFI-AVENTIS (FR) 2009-03-12 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 (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-20090069368-A1 FGF-RECEPTOR AGONIST DIMERIC COMPOUNDS FGF2, FGFR1, FGF1 SMPD1 2013/4885MEN1 621/4885KMT2A 3395/4885

“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.