SCHEMBL5866770

SCHEMBL5866770

CCOc1ccc2oc(C(=NO)Nc3cccc(Cl)c3)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FADS1 O60427 1/20 0.48
MAOB P27338 3/20 0.48
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
MAPT P10636 5/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALOX15 P16050 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
F12 P00748 1/20 0.40
CSNK1D P48730 1/20 0.40
TP53 P04637 3/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
XBP1 P17861 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL5866768 1.00 FADS1 (0.48) FADS1MAOBMEN1KMT2AMAPT
SCHEMBL5866855 0.88 MAOB (0.60) FADS1MAOBMEN1KMT2AMAPT
SCHEMBL5866852 0.88 MAOB (0.60) FADS1MAOBMEN1KMT2AMAPT
SCHEMBL5866919 0.84 MAPT (0.45) FADS1MAOBMEN1KMT2AMAPT
SCHEMBL5866920 0.84 MAPT (0.45) FADS1MAOBMEN1KMT2AMAPT
SCHEMBL5866771 0.80 IDO1 (0.56) MAOBMEN1KMT2ASLC26A4
SCHEMBL5866934 0.76 BCAT1 (0.47) KMT2AMAPTSMN1; SMN2KDM4ELMNA
SCHEMBL5866846 0.76 MEN1 (0.52) MAOBMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5866847 0.76 MEN1 (0.52) MAOBMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL5866763 0.75 MAOB (0.56) MAOBMEN1KMT2AMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7148259-B1 Antibacterial agents AMGEN INC. (US) 2006-12-12 US disclosed
US-20060270651-A1 ANTIBACTERIAL AGENTS AMGEN INC. (US) 2006-11-30 US disclosed
US-7053234-B2 Antibacterial agents AMGEN INC. (US) 2006-05-30 US disclosed
US-20040235911-A1 hydroxyamidines; antibiotic resistance TULARIK INC. 2004-11-25 US disclosed
US-6780858-B2 Antibacterial agents TULARIK INC. 2004-08-24 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 (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-20040235911-A1 hydroxyamidines; antibiotic resistance HNMT, HDHD5, ABCC1 FADS1 2354/4885MAOB 876/4885MEN1 1387/4885
US-20060270651-A1 ANTIBACTERIAL AGENTS MRPL21, HDHD5, CLPP FADS1 3143/4885MAOB 1286/4885MEN1 2812/4885

“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.