SCHEMBL17169159

SCHEMBL17169159

Cc1ccc(SCC(C)C2CC(=O)C(c3ccccc3Br)=C(O)C2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.35
PKM P14618 1/20 0.34
NPSR1 Q6W5P4 4/20 0.33
HTT P42858 1/20 0.33
MAPT P10636 4/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HKDC1 Q2TB90 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
MAPK1 P28482 3/20 0.32
POLB P06746 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
GLA P06280 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL17169162 0.89 MAPT (0.35) L3MBTL1PKMNPSR1MAPTMEN1
SCHEMBL17122122 0.89 TERT (0.32) SMN1; SMN2
SCHEMBL17169166 0.87 PKM (0.35) L3MBTL1PKMNPSR1MAPTMEN1
SCHEMBL17169164 0.85 NPC1 (0.32) L3MBTL1PKMNPSR1MAPTMEN1
SCHEMBL17169163 0.85 PKM (0.32) L3MBTL1PKMNPSR1HTTMAPT
SCHEMBL17169161 0.83 KMT2A (0.35) L3MBTL1NPSR1MAPTMEN1KMT2A
SCHEMBL17169153 0.82 TBXA2R (0.35) L3MBTL1NPSR1MAPTMEN1KMT2A
SCHEMBL17169157 0.82 MEN1 (0.33) L3MBTL1MAPTMEN1KMT2A
SCHEMBL15944254 0.80 KMT2A (0.36) L3MBTL1MAPTMEN1KMT2ANPC1
SCHEMBL15944365 0.79 L3MBTL1 (0.41) L3MBTL1PKMNPSR1HTTMAPT

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-9414588-B2 Herbicide composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-16 US disclosed
US-20150289505-A1 HERBICIDE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-15 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-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 L3MBTL1 4359/4885PKM 1010/4885NPSR1 915/4885

“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.