SCHEMBL3608070

SCHEMBL3608070

COCOc1cc(OCc2ccccc2)c(C)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
MAPK1 P28482 2/20 0.45
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
NPC1 O15118 1/20 0.43
NFKB1 P19838 1/20 0.43
RAB9A P51151 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
RHEB Q15382 1/20 0.43
MCL1 Q07820 1/20 0.41
MRGPRX4 Q96LA9 3/20 0.41
STAT3 P40763 1/20 0.40

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
SCHEMBL3605162 0.83 KDM4E (0.44) L3MBTL1MAPK1MAPTTDP1SMN1; SMN2
SCHEMBL3605301 0.83 MAPT (0.45) L3MBTL1MAPK1MAPTTDP1SMN1; SMN2
SCHEMBL3607984 0.81 PDCD1 (0.51) L3MBTL1MAPK1MAPTSMN1; SMN2ALDH1A1
SCHEMBL3613087 0.81 SMN1; SMN2 (0.42) L3MBTL1MAPK1MAPTTDP1SMN1; SMN2
SCHEMBL13744661 0.79 L3MBTL1 (0.53) L3MBTL1MAPK1MAPTTDP1SMN1; SMN2
SCHEMBL16097608 0.78 MAOB (0.50) L3MBTL1MAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL6202378 0.78 MAPT (0.60) L3MBTL1MAPK1MAPTTDP1MRGPRX4
SCHEMBL3608836 0.78 FFAR4 (0.49) L3MBTL1MAPK1MAPTTDP1SMN1; SMN2
SCHEMBL25081934 0.78 MAPT (0.64) L3MBTL1MAPK1MAPTTDP1SMN1; SMN2
SCHEMBL6035769 0.77 MAOB (0.51) L3MBTL1MAPK1MAPTTDP1SMN1; 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 L3MBTL1 3563/4885MAPK1 470/4885MAPT 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.