SCHEMBL10161344

SCHEMBL10161344

COC(=O)c1c(C)cc2c(Br)cccc2c1OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.51
TDP1 Q9NUW8 3/20 0.51
ALDH1A1 P00352 2/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50
TP53 P04637 1/20 0.50
USP2 O75604 1/20 0.50
TSHR P16473 1/20 0.50
HSD17B10 Q99714 1/20 0.50
GAA P10253 1/20 0.48
PKM P14618 1/20 0.48
THRA P10827 2/20 0.43
THRB P10828 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL10161340 0.89 THRA (0.42) MAPTTDP1ALDH1A1LMNAHPGD
SCHEMBL10160847 0.82 CA12 (0.41) MAPTALDH1A1HPGDGAAPKM
SCHEMBL10196157 0.82 THRA (0.40) MAPTTDP1HPGDTP53TSHR
SCHEMBL10161449 0.81 MAPT (0.54) MAPTTDP1ALDH1A1LMNAHPGD
SCHEMBL31636665 0.78 USP2 (0.49) MAPTTDP1ALDH1A1LMNAHPGD
SCHEMBL31636486 0.78 ALDH1A1 (0.51) MAPTTDP1ALDH1A1LMNAHPGD
SCHEMBL10161339 0.76 MRGPRX4 (0.46) MAPTTDP1ALDH1A1LMNAHPGD
SCHEMBL10161338 0.76 HPGD (0.46) MAPTTDP1ALDH1A1LMNAHPGD
SCHEMBL10160846 0.76 CA12 (0.46) MAPTALDH1A1LMNAHPGDUSP2
SCHEMBL10160835 0.75 L3MBTL1 (0.41) MAPTTDP1ALDH1A1LMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115819-A1 Pentacycline Compounds TETRAPHASE PHARMACEUTICALS, INC. 2012-05-10 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-20120115819-A1 Pentacycline Compounds TSLP, IL5, IL17A MAPT 734/4885TDP1 2230/4885ALDH1A1 1598/4885

“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.