SCHEMBL4154931

SCHEMBL4154931

O=C(O)C1=CC2(CCC1S(=O)(=O)Nc1ccccc1Cl)O[C@H](CO)[C@@H](CO)O2

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTK2B Q14289 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TSHR P16473 1/20 0.35
TLR4 O00206 4/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
KMT2A Q03164 2/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
POLB P06746 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
FAAH O00519 1/20 0.31
P2RX7 Q99572 1/20 0.31

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
SCHEMBL17727700 1.00 PTK2B (0.35) PTK2BKDM4ETSHRTLR4SMN1; SMN2
SCHEMBL4144948 0.88 TLR4 (0.38) TSHRTLR4KMT2AHCRTR1HCRTR2
SCHEMBL17727716 0.88 MCL1 (0.33) KMT2AHCRTR1HCRTR2ALDH1A1
SCHEMBL4146435 0.88 MCL1 (0.33) KMT2AHCRTR1HCRTR2ALDH1A1
SCHEMBL4150740 0.88 HCRTR1 (0.32) HCRTR1HCRTR2
SCHEMBL1870224 0.87 TLR4 (0.48) KDM4ETSHRTLR4SMN1; SMN2KMT2A
SCHEMBL1862290 0.87 TLR4 (0.48) KDM4ETSHRTLR4SMN1; SMN2KMT2A
SCHEMBL4147605 0.87 TLR4 (0.41) KDM4ETLR4KMT2AMEN1
SCHEMBL14136690 0.87 TLR4 (0.49) TLR4KMT2ANPC1RAB9APOLB
SCHEMBL4141115 0.87 TLR4 (0.49) TLR4KMT2ANPC1RAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1935879-B1 SUBSTITUTED CYCLOALKENE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2016-05-11 EP disclosed
US-RE43858-E1 Substituted cycloalkene derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-12-11 US disclosed
US-20090233952-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-17 US disclosed
EP-1935879-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2008-06-25 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-20090233952-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE CD40, LITAF, TNF PTK2B 448/4885KDM4E 4338/4885TSHR 3200/4885

“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.