SCHEMBL1789290

SCHEMBL1789290

C=C(CCC(C)=Cc1ccccc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.52
RECQL P46063 1/20 0.45
HTT P42858 1/20 0.44
GRIK1 P39086 1/20 0.43
GRIK2 Q13002 1/20 0.43
TSHR P16473 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AKR1C1 Q04828 1/20 0.42
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MTNR1A P48039 2/20 0.41
MTNR1B P49286 2/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL1793881 0.85 CYP2C9 (0.46) AKR1C3HTTGRIK1ALDH1A1CYP2C9
SCHEMBL1791239 0.85 AKR1C3 (0.36) AKR1C3RECQLGRIK1GRIK2ALDH1A1
SCHEMBL10352720 0.84 AKR1C3 (0.53) AKR1C3RECQLHTTGRIK1GRIK2
SCHEMBL1790765 0.83 RAB9A (0.44) AKR1C3TSHRALDH1A1CYP3A4LMNA
Styrene SCHEMBL18587738 0.82 AKR1C3 (0.47) AKR1C3RECQLHTTGRIK1GRIK2
SCHEMBL3274821 0.82 RECQL (0.55) AKR1C3RECQLHTTGRIK1GRIK2
SCHEMBL3360462 0.82 RECQL (0.55) AKR1C3RECQLHTTGRIK1GRIK2
SCHEMBL1789109 0.81 MEN1 (0.45) RECQLHTTALDH1A1SMN1; SMN2LMNA
SCHEMBL5965882 0.79 AKR1C3 (0.43) AKR1C3RECQLHTTTSHRALDH1A1
SCHEMBL5965987 0.79 AKR1C3 (0.43) AKR1C3RECQLHTTTSHRALDH1A1

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-20110123929-A1 OXIME COMPOUND, PHOTOSENSITIVE COMPOSITION, COLOR FILTER, PRODUCTION METHOD FOR THE COLOR FILTER, AND LIQUID CRYSTAL DISPLAY ELEMENT FUJIFILM CORPORATION (JP) 2011-05-26 US disclosed
US-7041416-B2 Photosensitive resin composition, transfer material, image forming method, color filter and producing method thereof and photomask and producing method thereof FUJI PHOTO FILM CO., LTD. (JP) 2006-05-09 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-20110123929-A1 OXIME COMPOUND, PHOTOSENSITIVE COMPOSITION, COLOR FILTER, PRODUCTION METHOD FOR THE COLOR FILTER, AND LIQUID CRYSTAL DISPLAY ELEMENT PPOX, CRY2, HCCS AKR1C3 623/4885RECQL 1460/4885HTT 4755/4885

“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.