SCHEMBL22005000

SCHEMBL22005000

Ic1ccccc1OCCOc1ccccc1I

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
LMNA P02545 2/20 0.50
JAK2 O60674 1/20 0.50
GAA P10253 1/20 0.50
ALDH1A1 P00352 5/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
KDM4E B2RXH2 2/20 0.46
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
RECQL P46063 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KMT2A Q03164 1/20 0.41
PTK2B Q14289 1/20 0.41
HTR1A P08908 1/20 0.40
HTR7 P34969 1/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39

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
SCHEMBL2705419 0.92 KDM4E (0.44) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL22005040 0.92 KDM4E (0.44) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL22005008 0.90 NPC1 (0.47) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL30519457 0.89 MAPT (0.42) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL1144804 0.89 MAPT (0.42) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL23630245 0.86 KDM4E (0.40) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL21475436 0.86 KDM4E (0.40) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL10458218 0.86 KDM4E (0.45) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL91232 0.86 ALDH1A1 (0.50) MAPTLMNAJAK2GAAALDH1A1
SCHEMBL9968957 0.86 CYP1A2 (0.47) MAPTLMNAJAK2GAAALDH1A1

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-11168161-B2 Biaryl phenoxy group IV transition metal catalysts for olefin polymerization DOW GLOBAL TECHNOLOGIES LLC (US) 2021-11-09 US disclosed
US-20200157254-A1 BIARYL PHENOXY GROUP IV TRANSITION METAL CATALYSTS FOR OLEFIN POLYERMIZATION DOW GLOBAL TECHNOLOGIES LLC (US) 2020-05-21 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-11168161-B2 Biaryl phenoxy group IV transition metal catalysts for olefin polymerization PPOX, LIG4, PARG MAPT 769/4885LMNA 3161/4885JAK2 1285/4885

“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.