SCHEMBL5866928

SCHEMBL5866928

CCOc1ccc2oc(C(=O)O)cc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.68
HPGD P15428 3/20 0.68
POLB P06746 2/20 0.68
HSD17B10 Q99714 2/20 0.68
MEN1 O00255 1/20 0.68
BLM P54132 1/20 0.68
KMT2A Q03164 1/20 0.68
PIM1 P11309 4/20 0.61
THRA P10827 1/20 0.59
THRB P10828 1/20 0.59
LMNA P02545 1/20 0.58
TP53 P04637 1/20 0.58
KDM4E B2RXH2 3/20 0.55
FLT3 P36888 1/20 0.52
MAPK1 P28482 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL18591899 0.88 PIM1 (0.58) ALDH1A1HPGDPOLBHSD17B10MEN1
SCHEMBL9990974 0.88 PIM1 (0.58) ALDH1A1HPGDPOLBHSD17B10MEN1
SCHEMBL29994768 0.88 ALDH1A1 (0.55) ALDH1A1HPGDPOLBHSD17B10MEN1
SCHEMBL26109666 0.85 PIM1 (0.58) ALDH1A1HPGDPOLBHSD17B10MEN1
SCHEMBL11457413 0.85 PIM1 (0.54) ALDH1A1HPGDPOLBHSD17B10MEN1
SCHEMBL6414543 0.84 LMNA (0.62) ALDH1A1HPGDPOLBHSD17B10MEN1
SCHEMBL12795500 0.84 ALDH1A1 (0.52) ALDH1A1HPGDPOLBHSD17B10MEN1
SCHEMBL335319 0.83 KDM4E (0.66) ALDH1A1HPGDPIM1THRATHRB
SCHEMBL29527237 0.83 KDM4E (0.66) ALDH1A1HPGDPIM1THRATHRB
SCHEMBL4519057 0.82 PIM1 (0.58) ALDH1A1HPGDPOLBHSD17B10MEN1

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 8 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
EP-1246795-A2 ANTIBACTERIAL AGENTS Tularik Inc. (US) 2002-10-09 EP disclosed
US-20020045749-A1 Antibacterial agents AMGEN INC. 2002-04-18 US disclosed
WO-2001051456-A2 ANTIBACTERIAL AGENTS TULARIK INC. (US) 2001-07-19 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 (3 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 ALDH1A1 3919/4885HPGD 958/4885POLB 987/4885
US-20060270651-A1 ANTIBACTERIAL AGENTS MRPL21, HDHD5, CLPP ALDH1A1 2950/4885HPGD 900/4885POLB 719/4885
US-20020045749-A1 Antibacterial agents MRPL21, HDHD5, CLPP ALDH1A1 2950/4885HPGD 900/4885POLB 719/4885

“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.