SCHEMBL23329593

SCHEMBL23329593

Oc1cccc(-c2ccccc2)c1-c1ccccc1.[Ti]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.62
HPGD P15428 3/20 0.62
HSD17B10 Q99714 3/20 0.62
BCL2L1 Q07817 1/20 0.62
BACE1 P56817 3/20 0.52
HNF4A P41235 1/20 0.48
HDAC4 P56524 2/20 0.48
HDAC2 Q92769 2/20 0.48
HDAC8 Q9BY41 2/20 0.48
HDAC6 Q9UBN7 1/20 0.48
MAOA P21397 3/20 0.46
MAPT P10636 4/20 0.45
ALOX15 P16050 3/20 0.45
TDP1 Q9NUW8 3/20 0.45
TSHR P16473 2/20 0.45
MAPK1 P28482 2/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
ALOX5 P09917 1/20 0.45
MAOB P27338 1/20 0.45

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
SCHEMBL18150 0.98 ALDH1A1 (0.65) ALDH1A1HPGDHSD17B10BCL2L1BACE1
Hydrochloric Acid SCHEMBL29234311 0.95 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
Hydrogen Sulfide SCHEMBL27801479 0.95 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL28127028 0.95 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL30028001 0.95 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL28918851 0.95 ALDH1A1 (0.62) ALDH1A1HPGDHSD17B10BCL2L1BACE1
Bicarbonate SCHEMBL246690 0.91 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10BCL2L1BACE1
SCHEMBL675483 0.91 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10BCL2L1BACE1
Naphthalene SCHEMBL28779989 0.91 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10BCL2L1BACE1
Formaldehyde SCHEMBL29141444 0.91 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10BCL2L1BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220396647-A1 TITANIUM BIPHENYLPHENOL POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2022-12-15 US claimed
CN-114729081-A Biphenyl titanium phenolate polymerization catalyst 陶氏环球技术有限责任公司 2022-07-08 CN claimed
US-20220396647-A1 TITANIUM BIPHENYLPHENOL POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2022-12-15 US disclosed
US-20220396647-A1 TITANIUM BIPHENYLPHENOL POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2022-12-15 US disclosed
CN-114729081-A Biphenyl titanium phenolate polymerization catalyst 陶氏环球技术有限责任公司 2022-07-08 CN disclosed
CN-114729081-A Biphenyl titanium phenolate polymerization catalyst 陶氏环球技术有限责任公司 2022-07-08 CN disclosed
WO-2021091959-A1 TITANIUM BIPHENYLPHENOL POLYMERIZATION CATALYSTS DOW GLOBAL TECHNOLOGIES LLC (US) 2021-05-14 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-20220396647-A1 TITANIUM BIPHENYLPHENOL POLYMERIZATION CATALYSTS PCBP1, GSTP1, COMT ALDH1A1 101/4885HPGD 2632/4885HSD17B10 2121/4885

“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.