SCHEMBL5909259

SCHEMBL5909259

Cc1ccc(C(=O)N2CCN(c3ccccc3)CC2)c(O)n1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.61
TSHR P16473 5/20 0.61
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
USP2 O75604 2/20 0.61
LMNA P02545 5/20 0.55
HTT P42858 1/20 0.55
TP53 P04637 3/20 0.53
HSP90AA1 P07900 1/20 0.52
MAPT P10636 2/20 0.50
NPC1 O15118 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
KDM4E B2RXH2 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL5908888 0.87 ALDH1A1 (0.57) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL5909264 0.81 L3MBTL1 (0.48) ALDH1A1TSHRMEN1KMT2ALMNA
SCHEMBL5909304 0.81 ALDH1A1 (0.59) ALDH1A1TSHRMEN1KMT2ALMNA
SCHEMBL5908883 0.78 L3MBTL1 (0.46) ALDH1A1TSHRMEN1KMT2AUSP2
SCHEMBL10724385 0.77 ALDH1A1 (1.00) ALDH1A1TSHRMEN1KMT2AUSP2
SCHEMBL5908976 0.76 AKR1C3 (0.47) ALDH1A1TSHRHTTTP53MAPT
SCHEMBL9565911 0.75 ALDH1A1 (0.81) ALDH1A1TSHRMEN1KMT2AUSP2
SCHEMBL13406708 0.74 ALDH1A1 (0.63) ALDH1A1TSHRMEN1KMT2AUSP2
SCHEMBL5909090 0.73 ALDH1A1 (0.59) ALDH1A1TSHRHTTTP53NPC1
SCHEMBL27295608 0.71 ALDH1A1 (0.76) ALDH1A1TSHRMEN1KMT2AUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060030557-A1 Substituted pyridines having antiangiogenic activity HAVIV FORTUNA 2006-02-09 US disclosed
EP-1494672-A1 AMINOCARBONYL SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, PYRAZINES AND TRIAZINES HAVING ANTIANGIOGENIC ACTIVITY Abbott Laboratories (US) 2005-01-12 EP disclosed
US-20040014744-A1 Substituted pyridines having antiangiogenic activity ABBOTT LABORATORIES 2004-01-22 US disclosed
WO-2003086398-A1 AMINOCARBONYL SUBSTITUTED PYRIDINES, PYRIDAZINES, PYRIMIDINES, PYRAZINES AND TRIAZINES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2003-10-23 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 (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-20040014744-A1 Substituted pyridines having antiangiogenic activity FLT1, FLT4, KDR ALDH1A1 206/4885TSHR 3978/4885MEN1 2787/4885
US-20060030557-A1 Substituted pyridines having antiangiogenic activity FLT4, KDR, FLT1 ALDH1A1 424/4885TSHR 3670/4885MEN1 3483/4885

“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.