SCHEMBL3604504

SCHEMBL3604504

Cc1cc(Cl)c(Oc2c(C)c(C)nn2C)cc1OCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
HTT P42858 2/20 0.39
STAT3 P40763 1/20 0.39
ATP4A P20648 1/20 0.37
ATP4B P51164 1/20 0.37
MAPK14 Q16539 2/20 0.37
PKM P14618 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
NPC1 O15118 1/20 0.36
NFKB1 P19838 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
BRD4 O60885 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL3608988 0.86 CYP1A2 (0.50) RHEBL3MBTL1MAPTSMN1; SMN2HTT
SCHEMBL3613728 0.84 L3MBTL1 (0.40) L3MBTL1MAPTMAPK1TDP1SMN1; SMN2
SCHEMBL3606715 0.84 RHEB (0.36) RHEBL3MBTL1MAPTMAPK1TDP1
SCHEMBL3609621 0.81 RHEB (0.38) RHEBL3MBTL1MAPTMAPK1TDP1
SCHEMBL3609623 0.76 RHEB (0.43) RHEBSMN1; SMN2HTTATP4AATP4B
SCHEMBL3607091 0.76 CYP1A2 (0.48) RHEBL3MBTL1MAPTSMN1; SMN2HTT
SCHEMBL3602714 0.75 CYP1A2 (0.34) L3MBTL1MAPTTDP1SMN1; SMN2HTT
SCHEMBL3597527 0.75 PKM (0.37) L3MBTL1MAPTSMN1; SMN2HTTPKM
SCHEMBL3608070 0.74 L3MBTL1 (0.45) RHEBL3MBTL1MAPTMAPK1TDP1
SCHEMBL3611438 0.74 KDM4E (0.35) MAPTSMN1; SMN2

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-20100016396-A1 PYRAZOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-01-21 US disclosed
EP-2128138-A1 PYRAZOLE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2009-12-02 EP 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-20100016396-A1 PYRAZOLE COMPOUND SLC5A1, SLC5A2, GLP1R RHEB 2530/4885L3MBTL1 3563/4885MAPT 3754/4885

“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.