SCHEMBL7191364

SCHEMBL7191364

CC(C)=CCc1cc(Br)cc(CC=C(C)C)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B10 O60218 2/20 0.53
▸ AKR1B1 P15121 2/20 0.53
▸ AKR1C3 P42330 2/20 0.53
▸ MMP2 P08253 1/20 0.53
▸ PAK1 Q13153 1/20 0.53
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ HTT P42858 3/20 0.44
▸ HPGD P15428 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ TRPV4 Q9HBA0 1/20 0.43
▸ PTPN1 P18031 3/20 0.42
▸ ALOX5 P09917 2/20 0.42
▸ PTGES O14684 1/20 0.42

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
SCHEMBL12733155 0.83 AKR1B10 (0.56) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL7192466 0.79 AKR1B10 (0.53) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL14139155 0.79 HTT (0.60) AKR1B10AKR1B1AKR1C3MEN1KMT2A
SCHEMBL4117028 0.76 HTT (0.67) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL2492351 0.76 AKR1B10 (0.58) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL5165720 0.76 AKR1B10 (0.54) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL30199523 0.76 AKR1B10 (0.63) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL5166422 0.73 AKR1B10 (0.51) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL29486322 0.73 HTT (0.48) AKR1B10AKR1B1AKR1C3MMP2PAK1
SCHEMBL5774375 0.72 MEN1 (0.47) AKR1B10AKR1B1AKR1C3MMP2PAK1

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-20030065229-A1 Phenol derivatives, process for preparation of the same and use thereof KABUSHIKI KAISHA HAYASHIBARA SEIBUTSU KAGAKU KENKYUJO (JP) 2003-04-03 — — US disclosed
EP-1184362-A1 PHENOL DERIVATIVES, PROCESS FOR PREPARATION OF THE SAME AND USE THEREOF Kabushiki Kaisha Hayashibara Seibutsu Kagaku Kenkyujo (JP) 2002-03-06 — — EP 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-20030065229-A1 Phenol derivatives, process for preparation of the same and use thereof ACR, SHARPIN, AGPS AKR1B10 851/4885AKR1B1 1008/4885AKR1C3 192/4885

“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.

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