SCHEMBL1789109

SCHEMBL1789109

C=C(CCC(C)=Cc1ccc([N+](=O)[O-])cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
FBP1 P09467 2/20 0.44
MAPT P10636 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 2/20 0.42
MAPK1 P28482 1/20 0.41
BRAF P15056 1/20 0.41
LMNA P02545 2/20 0.40
HTT P42858 2/20 0.40
MAOB P27338 2/20 0.40
BCHE P06276 1/20 0.40
RAB9A P51151 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39
ATM Q13315 1/20 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
SCHEMBL1791532 0.83 FBP1 (0.44) MEN1KMT2AFBP1MAPTSMN1; SMN2
SCHEMBL1789290 0.81 AKR1C3 (0.52) MEN1KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL1791239 0.80 AKR1C3 (0.36) ALDH1A1KDM4EMAOBRAB9ANPC1
SCHEMBL1793881 0.80 CYP2C9 (0.46) FBP1ALDH1A1KDM4EHTTPOLB
SCHEMBL1790765 0.77 RAB9A (0.44) MAPTALDH1A1KDM4ELMNARAB9A
Methacrylic Acid SCHEMBL28231449 0.77 AKR1C3 (0.51) MEN1KMT2AFBP1MAPTSMN1; SMN2
SCHEMBL1791768 0.76 GRIK1 (0.48) MEN1KMT2AFBP1MAPTMAOB
SCHEMBL4631977 0.76 FBP1 (0.54) MEN1KMT2AFBP1MAPTSMN1; SMN2
SCHEMBL18484537 0.76 FBP1 (0.54) MEN1KMT2AFBP1MAPTSMN1; SMN2
SCHEMBL52681 0.76 AKR1C3 (0.58) MEN1KMT2AFBP1MAPTSMN1; SMN2

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 MEN1 4248/4885KMT2A 476/4885FBP1 2275/4885

“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.