SCHEMBL19258615

SCHEMBL19258615

Cc1ccc(CCc2ccc(C)o2)cc1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CHRM4 P08173 1/20 0.45
CHRM5 P08912 1/20 0.45
CHRM1 P11229 1/20 0.45
CYP2C9 P11712 1/20 0.45
CHRM3 P20309 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2A6 P11509 1/20 0.45
TAAR1 Q96RJ0 1/20 0.45
MAPT P10636 2/20 0.44
KCNH2 Q12809 1/20 0.41
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40
CHKA P35790 1/20 0.38
IDO1 P14902 1/20 0.38

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
SCHEMBL6475097 0.84 CHRM2 (0.58) CHRM2MEN1KMT2ACHRM4CHRM5
SCHEMBL24400970 0.81 MAPT (0.57) TAAR1MAPTALDH1A1IDO1
SCHEMBL4499814 0.81 ALDH1A1 (0.47) CHRM2MEN1KMT2ACHRM4CHRM5
SCHEMBL8973436 0.79 ALDH1A1 (0.46) CHRM2MEN1KMT2ACHRM4CHRM5
SCHEMBL11288839 0.76 CYP1A2 (0.68) MEN1KMT2ACYP1A2CYP2A6TAAR1
SCHEMBL143961 0.76 CYP1A2 (0.68) MEN1KMT2ACYP1A2CYP2A6TAAR1
SCHEMBL3723023 0.73
SCHEMBL8973362 0.73 CHRM2 (0.52) CHRM2MEN1KMT2ACHRM4CHRM5
SCHEMBL21762340 0.72 MAPT (0.41) CHRM2MEN1KMT2ACHRM4CHRM5
SCHEMBL11839445 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11220475-B2 Monomers from biomass NDSU RESEARCH FOUNDATION (US) 2022-01-11 US disclosed
US-20210198175-A9 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2021-07-01 US disclosed
US-20200140368-A1 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2020-05-07 US disclosed
US-20180093939-A9 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2018-04-05 US disclosed
US-9738753-B2 Programmed degradation of polymers derived from biomass NDSU RESEARCH FOUNDATION (US) 2017-08-22 US disclosed
US-20170233325-A1 NOVEL MONOMERS FROM BIOMASS NDSU RESEARCH FOUNDATION (US) 2017-08-17 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 (5 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-20210198175-A9 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS CHRM2 3439/4885MEN1 3775/4885KMT2A 4022/4885
US-20180093939-A9 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS CHRM2 3439/4885MEN1 3775/4885KMT2A 4022/4885
US-20170233325-A1 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS CHRM2 3439/4885MEN1 3775/4885KMT2A 4022/4885
US-20200140368-A1 NOVEL MONOMERS FROM BIOMASS DCXR, MANBA, PGLS CHRM2 3439/4885MEN1 3775/4885KMT2A 4022/4885
US-11220475-B2 Monomers from biomass DCXR, MGAM, ALG1 CHRM2 3559/4885MEN1 2052/4885KMT2A 3130/4885

“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.