SCHEMBL7931332

SCHEMBL7931332

CCCCOC(=O)C1(C)CO[CH]O1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
ATM Q13315 1/20 0.37
TSHR P16473 4/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.36
PSEN1 P49768 3/20 0.35
HPGD P15428 1/20 0.35
ESR1 P03372 6/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP2D6 P10635 1/20 0.34
MAPK1 P28482 1/20 0.34
NR1H2 P55055 1/20 0.34
RNASEL Q05823 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
PDE4D Q08499 1/20 0.33

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
SCHEMBL7921660 0.86 PSEN1 (0.39) ALDH1A1ATMTSHRTDP1L3MBTL1
SCHEMBL3807047 0.80 ALDH1A1 (0.52) ALDH1A1ATMTSHRTDP1L3MBTL1
SCHEMBL3043065 0.80 ALDH1A1 (0.52) ALDH1A1ATMTSHRTDP1L3MBTL1
SCHEMBL5072698 0.77 ALDH1A1 (0.44) ALDH1A1ATMTSHRTDP1L3MBTL1
SCHEMBL14967650 0.75 TSHR (0.46) ALDH1A1TSHRPSEN1MAPK1CYP3A4
SCHEMBL14967788 0.73 TSHR (0.49) ALDH1A1TSHRPSEN1HCAR2NAAA
SCHEMBL11158310 0.73 TSHR (0.49) ALDH1A1TSHRPSEN1HCAR2NAAA
SCHEMBL5075328 0.72 NAAA (0.43) ALDH1A1TSHRPSEN1MAPK1CYP3A4
SCHEMBL24137720 0.71 ALDH1A1 (0.41) ALDH1A1ATMTSHRTDP1L3MBTL1
SCHEMBL7931267 0.71 PSEN1 (0.44) ALDH1A1ATMTSHRTDP1L3MBTL1

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-20010031865-A1 Substituted 3-phenyluracils KLINTZ RALF (DE) 2001-10-18 US disclosed
US-6239074-B1 HERBICIDES, INSECTICIDES BASF AKTIENGESELLSCHAFT (DE) 2001-05-29 US disclosed
US-6204222-B1 SUITABLE AS HERBICIDES AND FOR DESICCATION/DEFOLIATION OF PLANTS BASF AKTIENGESELLSCHAFT (DE) 2001-03-20 US disclosed
EP-0604491-A1 SUBSTITUTED 3-PHENYLURACILS AS HERBICIDES BASF Aktiengesellschaft (DE) 1994-07-06 EP disclosed
WO-1993006090-A1 SUBSTITUTED 3-PHENYLURACILS AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-04-01 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-20010031865-A1 Substituted 3-phenyluracils CCR1, CCR6, CCR3 ALDH1A1 1864/4885ATM 1300/4885TSHR 1263/4885

“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.