SCHEMBL2296889

SCHEMBL2296889

C=CCN1C[C@@H](c2ccc(Cl)cc2)OCC1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.37
MDM2 Q00987 5/20 0.37
FADS1 O60427 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ANXA2 P07355 1/20 0.35
S100A10 P60903 1/20 0.35
GPBAR1 Q8TDU6 1/20 0.35
ALDH1A1 P00352 4/20 0.34
GAA P10253 2/20 0.34
HPGD P15428 2/20 0.34
CYP2C19 P33261 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
SRD5A1 P18405 1/20 0.34
DRD3 P35462 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL2297007 1.00 RECQL (0.37) RECQLMDM2FADS1HSD17B10ANXA2
SCHEMBL2296617 0.86 MDM2 (0.41) MDM2HSD17B10ALDH1A1GAACYP2C19
SCHEMBL2297604 0.86 MDM2 (0.41) MDM2HSD17B10ALDH1A1GAACYP2C19
SCHEMBL2295129 0.86 FADS1 (0.39) FADS1HSD17B10ALDH1A1GAAKDM4E
SCHEMBL2293784 0.86 FADS1 (0.39) FADS1HSD17B10ALDH1A1GAAKDM4E
SCHEMBL2295969 0.82 MAPT (0.40) ALDH1A1GAALMNA
SCHEMBL2295177 0.82 MAPT (0.40) ALDH1A1GAALMNA
SCHEMBL2294621 0.82 MDM2 (0.44) MDM2FADS1CYP2C19SRD5A1LMNA
SCHEMBL2297998 0.82 MDM2 (0.44) MDM2FADS1CYP2C19SRD5A1LMNA
SCHEMBL2294277 0.79 MMP7 (0.33) HSD17B10ALDH1A1GAAHPGDKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156804-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-06-18 US claimed
US-20110257392-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI-AVENTIS (FR) 2011-10-20 US disclosed
US-20110251385-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI-AVENTIS (FR) 2011-10-13 US disclosed
US-7994315-B2 Intermediate compound for synthesizing pharmaceutical agent and production method thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-09 US disclosed
EP-2221305-A1 Method for synthesizing intermediate compound for synthesizing a pharmaceutical agent Mitsubishi Tanabe Pharma Corporation (JP) 2010-08-25 EP disclosed
EP-2221304-A1 Method for synthesizing intermediate compound for synthesizing a pharmaceutical agent Mitsubishi Tanabe Pharma Corporation (JP) 2010-08-25 EP disclosed
US-20090156804-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-06-18 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 (3 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-20110257392-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 RECQL 3191/4885MDM2 1186/4885FADS1 3039/4885
US-20110251385-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 RECQL 3191/4885MDM2 1186/4885FADS1 3039/4885
US-20090156804-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 RECQL 3191/4885MDM2 1186/4885FADS1 3039/4885

“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.