SCHEMBL4401481

SCHEMBL4401481

C(OCC1CO1)C1CO1.c1ccc2c(c1)O2

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.52
ALDH1A1 P00352 5/20 0.47
GLA P06280 1/20 0.47
TSHR P16473 5/20 0.46
TP53 P04637 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HIF1A Q16665 2/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MGLL Q99685 2/20 0.38
MAPT P10636 2/20 0.37
HPGD P15428 2/20 0.37
CYP1A2 P05177 1/20 0.37
PPARG P37231 1/20 0.37

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
Acrylic Acid SCHEMBL4400640 0.84 TDP1 (0.42) TDP1ALDH1A1GLAMGLL
Naphthalene SCHEMBL1054782 0.83 TDP1 (0.55) TDP1ALDH1A1GLATSHRTP53
SCHEMBL28970015 0.81 TDP1 (0.82) TDP1ALDH1A1GLATSHRTP53
O-Xylene SCHEMBL27476227 0.81 ALDH1A1 (0.63) TDP1ALDH1A1GLATSHRTP53
Biphenyl SCHEMBL27996658 0.81 TDP1 (0.59) TDP1ALDH1A1GLATSHRTP53
Biphenyl SCHEMBL23045578 0.81 TDP1 (0.59) TDP1ALDH1A1GLATSHRTP53
Biphenyl SCHEMBL93293 0.81 TDP1 (0.59) TDP1ALDH1A1GLATSHRTP53
SCHEMBL10844030 0.80 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2MAPK1MAPTHPGD
SCHEMBL29234901 0.80 ALDH1A1 (0.45) TDP1ALDH1A1GLATSHRTP53
Benzene SCHEMBL151182 0.79 TSHR (0.59) TDP1ALDH1A1GLATSHRTP53

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
CN-101448874-A Stabilizers for improved open time of aqueous coatings HERCULES INC (US) 2009-06-03 CN claimed
CN-108351454-B Polarizing plate and image display device including the same 住友化学株式会社 2020-11-03 CN disclosed
CN-101448874-B Stabilizers for improved open time of aqueous coatings HERCULES INC 2012-07-18 CN disclosed
US-20090306422-A1 OLIGOMERIC URETHANE ACRYLATES, THEIR PREPARATION AND USE BASF COATINGS AG (DE) 2009-12-10 US disclosed
CN-101448874-A Stabilizers for improved open time of aqueous coatings HERCULES INC (US) 2009-06-03 CN 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-20090306422-A1 OLIGOMERIC URETHANE ACRYLATES, THEIR PREPARATION AND USE NOX1, CBR1, NOXO1 TDP1 1277/4885ALDH1A1 589/4885GLA 1949/4885

“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.