SCHEMBL10344754

SCHEMBL10344754

Cc1cccc2[nH]cc(CCCC(=O)O)c12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.58
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM4E B2RXH2 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
RECQL P46063 2/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
MAPT P10636 1/20 0.48
THRB P10828 1/20 0.48
DNMT1 P26358 1/20 0.48
CASP6 P55212 1/20 0.48
MCL1 Q07820 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
CYP1A2 P05177 2/20 0.47
CYP2D6 P10635 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47

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
SCHEMBL31036403 0.91 GPR84 (0.61) GPR84ALDH1A1MEN1KMT2AKDM4E
SCHEMBL15142475 0.91 GPR84 (0.61) GPR84ALDH1A1MEN1KMT2AKDM4E
SCHEMBL28931788 0.89 GPR84 (0.58) GPR84ALDH1A1KDM4EL3MBTL1GAA
SCHEMBL10344616 0.89 GPR84 (0.58) GPR84ALDH1A1MEN1KMT2AKDM4E
SCHEMBL10362102 0.86 GPR84 (0.58) GPR84ALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL1462463 0.85 GPR84 (0.54) GPR84ALDH1A1MEN1KMT2AKDM4E
SCHEMBL7128275 0.83 SLC6A4 (0.60) GPR84ALDH1A1MEN1KMT2AKDM4E
SCHEMBL6287959 0.82 ALDH1A1 (0.69) GPR84ALDH1A1MEN1KMT2AKDM4E
SCHEMBL9418838 0.81 SMN1; SMN2 (0.52) ALDH1A1MEN1KMT2AKDM4EL3MBTL1
SCHEMBL25711915 0.80 GPR84 (0.67) GPR84CYP1A2CYP2D6CYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200383331-A1 COMPOSITIONS AND METHODS FOR LARGE-SCALE IN VITRO PLANT BIOCULTURE BOOSHOOT LLC (US) 2020-12-10 US disclosed
WO-2013016198-A1 COMPOSITIONS, METHODS, AND SYSTEMS FOR MICROPROPAGATION OF PLANTS BOOSHOOT LLC (US) 2013-01-31 WO disclosed
WO-2012097380-A1 COMPOSITIONS AND METHODS FOR BAMBOO PULPING The Red Triangle, LLC (US) 2012-07-19 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-20200383331-A1 COMPOSITIONS AND METHODS FOR LARGE-SCALE IN VITRO PLANT BIOCULTURE MYB, MYCBP, PIM1 GPR84 4203/4885ALDH1A1 4628/4885MEN1 3748/4885

“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.