SCHEMBL965832

SCHEMBL965832

Cc1nn(C)c(-n2cc(Cl)c3cccnc32)c1/C=C/C(=O)NS(=O)(=O)c1cn(C)cn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.37
HDAC1 Q13547 3/20 0.35
ELANE P08246 1/20 0.33
LMNA P02545 1/20 0.32
KAT8 Q9H7Z6 2/20 0.31
KAT5 Q92993 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
HDAC2 Q92769 2/20 0.31
PTGER3 P43115 2/20 0.31
SLC6A9 P48067 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 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
SCHEMBL965833 1.00 GLO1 (0.37) GLO1HDAC1ELANELMNAKAT8
SCHEMBL5126136 0.87 ELANE (0.36) HDAC1ELANEHDAC2PTGER3HDAC3
SCHEMBL5126154 0.87 ELANE (0.36) HDAC1ELANEHDAC2PTGER3HDAC3
SCHEMBL965295 0.87 EGFR (0.41) HDAC1ELANEKDM4EHDAC2HDAC3
SCHEMBL965294 0.87 EGFR (0.41) HDAC1ELANEKDM4EHDAC2HDAC3
SCHEMBL963132 0.81 L3MBTL1 (0.48) ELANELMNAMAPTNR2F2HTT
SCHEMBL963133 0.81 L3MBTL1 (0.48) ELANELMNAMAPTNR2F2HTT
SCHEMBL965586 0.81 PPARG (0.42)
SCHEMBL965588 0.81 PPARG (0.42)
SCHEMBL964275 0.81 ELANE (0.32) ELANEKDM4EPOLBMAPTNR2F2

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
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED 2011-01-13 US disclosed
EP-2118066-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA Takeda Pharmaceutical Company Limited (JP) 2009-11-18 EP disclosed
WO-2008099794-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-21 WO disclosed
US-20080194617-A1 Fused ring compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-08-14 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 (2 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-20080194617-A1 Fused ring compound SLC5A1, SLC5A2, GPR119 GLO1 50/4885HDAC1 108/4885ELANE 2515/4885
US-20110009384-A1 FUSED RING COMPOUNDS AS PARTIAL AGONISTS OF PPAR-GAMMA PPARA, PPARD, PPARG GLO1 833/4885HDAC1 338/4885ELANE 3595/4885

“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.