SCHEMBL3276602

SCHEMBL3276602

O=C(O)c1cc2ccsc2n1Cc1cccc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
LMNA P02545 1/20 0.54
FDPS P14324 2/20 0.48
MAPT P10636 2/20 0.45
CMA1 P23946 1/20 0.44
CCR2 P41597 4/20 0.43
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 1/20 0.42
JAK2 O60674 1/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 1/20 0.42
PAX8 Q06710 1/20 0.42
MCL1 Q07820 1/20 0.42
TSHR P16473 2/20 0.42
KDM1A O60341 1/20 0.41
RCOR1 Q9UKL0 1/20 0.41
HPGD P15428 1/20 0.40
SLC22A12 Q96S37 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL3277148 0.87 L3MBTL1 (0.52) L3MBTL1LMNAFDPSMAPTCCR2
SCHEMBL3277418 0.86 L3MBTL1 (0.74) L3MBTL1LMNAMAPTALDH1A1TSHR
SCHEMBL3276177 0.81 POLB (0.54) LMNAFDPSMAPTCMA1CCR2
SCHEMBL3276218 0.76 FDPS (0.56) FDPSCMA1CCR2TDP1MCL1
SCHEMBL3259343 0.75 FDPS (0.48) FDPSCMA1CCR2TDP1MCL1
SCHEMBL3277134 0.75 F10 (0.57) FDPSCMA1CCR2MCL1KDM4E
SCHEMBL3276471 0.74 CCR2 (0.76) CCR2
SCHEMBL3283142 0.74 CCR2 (0.61) FDPSCCR2MCL1
SCHEMBL3283197 0.74 CCR2 (0.56) FDPSCMA1CCR2ALDH1A1MCL1
SCHEMBL3275429 0.74 CCR9 (0.55) FDPSCMA1CCR2TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1966134-B1 NOVEL FUSED PYRROLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-03-12 EP disclosed
EP-1966134-B1 NOVEL FUSED PYRROLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-03-12 EP disclosed
CN-101351446-B Novel fused pyrrole derivatives HOFFMANN LA ROCHE 2011-10-05 CN disclosed
US-7696240-B2 Fused pyrrole derivatives HOFFMANN-LA ROCHE INC. (US) 2010-04-13 US disclosed
US-7696240-B2 Fused pyrrole derivatives HOFFMANN-LA ROCHE INC. (US) 2010-04-13 US disclosed
US-7696240-B2 Fused pyrrole derivatives HOFFMANN-LA ROCHE INC. (US) 2010-04-13 US disclosed
CN-101351446-A Novel fused pyrrole derivatives HOFFMANN LA ROCHE (CH) 2009-01-21 CN disclosed
EP-1966134-A1 NOVEL FUSED PYRROLE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-09-10 EP disclosed
WO-2007068621-A1 NOVEL FUSED PYRROLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-06-21 WO disclosed
WO-2007068621-A1 NOVEL FUSED PYRROLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-06-21 WO disclosed
US-20070142452-A1 Fused pyrrole derivatives HOFFMANN-LA ROCHE INC. 2007-06-21 US disclosed
US-20070142452-A1 Fused pyrrole derivatives HOFFMANN-LA ROCHE INC. 2007-06-21 US disclosed
US-20070142452-A1 Fused pyrrole derivatives HOFFMANN-LA ROCHE INC. 2007-06-21 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-20070142452-A1 Fused pyrrole derivatives CMA1, PREP, CPA3 L3MBTL1 4757/4885LMNA 3734/4885FDPS 1977/4885

“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.