SCHEMBL5579728

SCHEMBL5579728

CCCCCCCCCCCC(=O)n1ccnc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 6/20 0.47
TBXA2R P21731 2/20 0.44
CES2 O00748 3/20 0.41
CES1 P23141 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
FAAH O00519 1/20 0.41
NAAA Q02083 1/20 0.41
TDP1 Q9NUW8 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
PPARG P37231 3/20 0.39
PPARD Q03181 3/20 0.39
PPARA Q07869 3/20 0.39
TSHR P16473 2/20 0.39
GPR84 Q9NQS5 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
SLC22A6 Q4U2R8 1/20 0.39
SLC22A8 Q8TCC7 1/20 0.39
TLR2 O60603 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
SCHEMBL5580070 1.00 TBXAS1 (0.47) TBXAS1TBXA2RCES2CES1L3MBTL1
SCHEMBL2944337 1.00 TBXAS1 (0.47) TBXAS1TBXA2RCES2CES1L3MBTL1
SCHEMBL5966050 1.00 TBXAS1 (0.47) TBXAS1TBXA2RCES2CES1L3MBTL1
SCHEMBL5580017 1.00 TBXAS1 (0.47) TBXAS1TBXA2RCES2CES1L3MBTL1
SCHEMBL3199941 1.00 TBXAS1 (0.47) TBXAS1TBXA2RCES2CES1L3MBTL1
SCHEMBL20078981 1.00 TBXAS1 (0.47) TBXAS1TBXA2RCES2CES1L3MBTL1
SCHEMBL5966061 0.98 TBXAS1 (0.44) TBXAS1TBXA2RCES2CES1L3MBTL1
SCHEMBL28774336 0.93 TBXAS1 (0.42) TBXAS1TBXA2RCES2CES1TDP1
SCHEMBL9735799 0.91 ALDH1A1 (0.49) TBXA2RFAAHTDP1MEN1KMT2A
SCHEMBL10428746 0.91 ALDH1A1 (0.49) TBXA2RFAAHTDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100273116-A1 SILVER HALIDE PHOTOSENSITIVE MATERIAL FUJIFILM CORPORATION (JP) 2010-10-28 US disclosed
US-20070191274-A1 Active hedgehog protein conjugate ONTOGENY, INC. 2007-08-16 US disclosed
US-20070065869-A1 Methods for producing ligand arrays HARGREAVES JOHN S 2007-03-22 US disclosed
US-7153836-B2 Active hedgehog protein conjugate CURIS, INC. (US) 2006-12-26 US disclosed
EP-1594883-A2 COVALENT MODIFICATION OF RNA FOR IN VITRO AND IN VIVO DELIVERY Mirus Corporation (US) 2005-11-16 EP disclosed
EP-0953576-B1 Active hedgehog protein conjugate, process for its production and use CURIS INC (US) 2005-11-02 EP disclosed
EP-1557427-A2 Hedgehog protein conjugate Curis, Inc. (US) 2005-07-27 EP disclosed
US-20050148510-A1 Active hedgehog protein conjugate CURIS, INC. (US) 2005-07-07 US disclosed
US-6818623-B2 COMPRISES MORPHOGENIC TRANSMEMBRANE POLYPEPTIDE WITH INCREASED ACTIVITY FOR TREATING BONE, NEURODEGENERATIVE AND MUSCLE DISORDERS CURIS, INC. 2004-11-16 US disclosed
WO-2004076630-A2 COVALENT MODIFICATION OF RNA FOR IN VITRO AND IN VIVO DELIVERY MIRUS CORPORATION (US) 2004-09-10 WO disclosed
US-20040167090-A1 Covalent modification of RNA for in vitro and in vivo delivery Arrowhead Madison Inc. 2004-08-26 US disclosed
US-20030139574-A1 Active hedgehog protein conjugate ROCHE DIAGNOSTICS GMBH (DE) 2003-07-24 US disclosed
US-6468978-B1 CONJUGATE COMPRISING 1 TO 4 MOIETIES COVALENTLY BOUND TO POLYPEPTIDE COMPRISING HEDGEHOG N-TERMINAL DOMAIN, EACH BEING POLYPEPTIDE CONTAINING 10 TO 30 HYDROPHOBIC AMINO ACIDS OR POSITIVELY CHARGED AMINO ACIDS FORMING TRANSMEMBRANE HELICES CURIS, INC. 2002-10-22 US disclosed
EP-0953576-A1 Active hedgehog protein conjugate, process for its production and use BOEHRINGER MANNHEIM GMBH (DE) 1999-11-03 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-20040167090-A1 Covalent modification of RNA for in vitro and in vivo delivery NSUN2, NSUN3, RNASE1 TBXAS1 4219/4885TBXA2R 4736/4885CES2 663/4885

“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.