SCHEMBL22648161

SCHEMBL22648161

C=CC(=O)OCCNc1ccc(C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
TGM2 P21980 1/20 0.47
THRB P10828 1/20 0.43
TSHR P16473 5/20 0.42
HPGD P15428 1/20 0.42
ALDH1A1 P00352 4/20 0.42
TP53 P04637 2/20 0.42
HIF1A Q16665 2/20 0.42
CYP3A4 P08684 1/20 0.42
HSD17B10 Q99714 1/20 0.42
DHODH Q02127 1/20 0.41
PTPN1 P18031 1/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KMT2A Q03164 1/20 0.38
NLRP1 Q9C000 1/20 0.38
FFAR1 O14842 1/20 0.37

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
SCHEMBL23409891 0.85 TSHR (0.44) MAPTTHRBTSHRHPGDALDH1A1
SCHEMBL988048 0.84 THRB (0.57) MAPTTGM2THRBTSHRHPGD
SCHEMBL22648042 0.84 SMN1; SMN2 (0.45) THRBTSHRHPGDALDH1A1TP53
SCHEMBL24439640 0.84 THRB (0.40) MAPTTHRBTSHRHPGDALDH1A1
SCHEMBL23463871 0.82 THRB (0.56) THRBTSHRHPGDALDH1A1TP53
SCHEMBL3253043 0.82 GAA (0.54) MAPTTGM2HPGDALDH1A1TP53
SCHEMBL7633786 0.82 THRB (0.51) MAPTTGM2THRBTSHRHPGD
SCHEMBL7592166 0.81 THRB (0.43) MAPTTHRBTSHRHPGDALDH1A1
SCHEMBL6446183 0.80 MAPT (0.55) MAPTALDH1A1CYP3A4DHODHPTPN1
SCHEMBL7056940 0.80 TGM2 (0.54) MAPTTGM2THRBTSHRALDH1A1

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
WO-2022104113-A1 SUBSTITUTED MONO- AND POLY-PHENYL-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS FACEBOOK TECHNOLOGIES, LLC (US) 2022-05-19 WO disclosed
WO-2022104137-A1 SUBSTITUTED PROPANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS FACEBOOK TECHNOLOGIES, LLC (US) 2022-05-19 WO disclosed
WO-2021108232-A1 ANTHRAQUINONE DERIVATIZED MONOMERS AND POLYMERS FOR VOLUME BRAGG GRATINGS FACEBOOK TECHNOLOGIES, LLC (US) 2021-06-03 WO disclosed
WO-2021108204-A1 AROMATIC SUBSTITUTED ETHANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS FACEBOOK TECHNOLOGIES, LLC (US) 2021-06-03 WO disclosed
US-20210155584-A1 AROMATIC SUBSTITUTED METHANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS META PLATFORMS TECHNOLOGIES, LLC 2021-05-27 US disclosed
WO-2020227264-A1 FLUORENE DERIVATIZED MONOMERS AND POLYMERS FOR VOLUME BRAGG GRATINGS FACEBOOK TECHNOLOGIES, LLC (US) 2020-11-12 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-20210155584-A1 AROMATIC SUBSTITUTED METHANE-CORE MONOMERS AND POLYMERS THEREOF FOR VOLUME BRAGG GRATINGS SMAD2, MAFG, MYO1G MAPT 415/4885TGM2 1623/4885THRB 4727/4885

“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.