SCHEMBL5948552

SCHEMBL5948552

Oc1ccc(-c2c(Cl)c(O)c(Cl)c(Cl)c2Cl)c(Cl)c1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.43
MAPK1 P28482 3/20 0.43
HPGD P15428 5/20 0.42
HSD17B10 Q99714 5/20 0.42
TSHR P16473 5/20 0.42
MEN1 O00255 3/20 0.42
ALDH1A1 P00352 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
LMNA P02545 2/20 0.42
HSP90AA1 P07900 1/20 0.33
USP2 O75604 2/20 0.32
TP53 P04637 2/20 0.32
THRB P10828 2/20 0.32
ALOX15 P16050 2/20 0.32
BRCA1 P38398 2/20 0.32
GLA P06280 1/20 0.32
ALOX12 P18054 1/20 0.32
BLM P54132 1/20 0.32
ESR1 P03372 2/20 0.32

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
SCHEMBL5948554 0.96 CYP3A4 (0.46) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL5948713 0.89 CYP3A4 (0.44) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL5948304 0.78 HSD17B10 (0.46) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL5949074 0.77 TSHR (0.48) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL6273598 0.77 CYP3A4 (0.60) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL5948549 0.74 HSD17B10 (0.41) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL5948476 0.73 TSHR (0.52) CYP3A4MAPK1HPGDHSD17B10TSHR
Pentachlorophenol SCHEMBL28273889 0.73 CYP3A4 (0.80) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL5948181 0.72 HSD17B10 (0.50) CYP3A4MAPK1HPGDHSD17B10TSHR
SCHEMBL5948397 0.72 ESR1 (0.48) CYP3A4HPGDHSD17B10TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7034173-B2 Chemical products suited for use as co-catalysts, method for the preparation thereof and their use in catalyst systems for producing polyolefins BASELL POLYOLEFINE GMBH (DE) 2006-04-25 US disclosed
US-20030144434-A1 Chemical products suited for use as co-catalysts, method for the preparation thereof and their use in catalyst systems for producing polyolefins EQUISTAR CHEMICALS, LP 2003-07-31 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 (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-20030144434-A1 Chemical products suited for use as co-catalysts, method for the preparation thereof and their use in catalyst systems for producing polyolefins CBR1, COX6C, CBR3 CYP3A4 260/4885MAPK1 4081/4885HPGD 1941/4885

“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.