SCHEMBL3931360

SCHEMBL3931360

CCC(CC(=O)O)c1ccco1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.68
HPGD P15428 4/20 0.49
GLA P06280 1/20 0.49
RECQL P46063 1/20 0.49
KMT2A Q03164 7/20 0.48
PKM P14618 4/20 0.48
POLB P06746 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
PTPN1 P18031 1/20 0.48
PTPN7 P35236 1/20 0.48
BLM P54132 1/20 0.48
ESR2 Q92731 1/20 0.48
CYP2C19 P33261 3/20 0.47
ALDH1A1 P00352 6/20 0.44
MEN1 O00255 5/20 0.44
MAPT P10636 4/20 0.44
TSHR P16473 1/20 0.44
GAA P10253 1/20 0.43
NPSR1 Q6W5P4 2/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL9579872 0.86 MIF (0.53) MIFHPGDGLARECQLKMT2A
SCHEMBL29110955 0.85 MIF (0.50) MIFHPGDGLARECQLKMT2A
SCHEMBL12464824 0.82 MIF (0.43) MIFHPGDGLARECQLKMT2A
SCHEMBL1207891 0.79 MIF (0.56) MIFHPGDGLARECQLKMT2A
SCHEMBL11354508 0.79 MIF (0.42) MIFHPGDGLARECQLKMT2A
SCHEMBL6176922 0.77 MIF (0.80) MIFHPGDKMT2APKMPOLB
SCHEMBL3814849 0.77 KMT2A (0.62) MIFHPGDGLARECQLKMT2A
SCHEMBL4453575 0.77 KMT2A (0.62) MIFHPGDGLARECQLKMT2A
SCHEMBL5514338 0.76 ALDH1A1 (0.60) MIFHPGDGLARECQLKMT2A
SCHEMBL11749315 0.76 MIF (0.53) MIFHPGDGLARECQLKMT2A

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
EP-2044063-A1 PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER Astra Zeneca AB (SE) 2009-04-08 EP disclosed
WO-2008001070-A1 PYRIMIDINE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-01-03 WO disclosed
US-20080004302-A1 Novel Compounds ASTRAZENECA AB (SE) 2008-01-03 US disclosed
US-5800897-A Air freshener composition containing a fiber pad EASTMAN CHEMICAL COMPANY (US) 1998-09-01 US disclosed
WO-1997026926-A1 AIR FRESHENER COMPOSITION CONTAINING A FIBER PAD EASTMAN CHEMICAL COMPANY (US) 1997-07-31 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 (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-20080004302-A1 Novel Compounds CYP11B2, CYP11B1, CYP46A1 MIF 1584/4885HPGD 307/4885GLA 1119/4885

“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.