SCHEMBL4745085

SCHEMBL4745085

O=C(O)C[C@H](O)CCCBr

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 4/20 0.57
SLC22A6 Q4U2R8 1/20 0.55
GABRR1 P24046 2/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
MMP12 P39900 3/20 0.39
MMP13 P45452 3/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP14 P50281 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FFAR4 Q5NUL3 1/20 0.36
FFAR1 O14842 1/20 0.36
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL27394390 1.00 GPR84 (0.57) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL666360 1.00 GPR84 (0.57) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL5158740 0.93 GPR84 (0.61) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL6232898 0.91 GPR84 (0.64) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL667385 0.91 GPR84 (0.64) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL4748559 0.91 GPR84 (0.64) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL5158401 0.91 GPR84 (0.64) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL535609 0.91 GPR84 (0.64) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL667943 0.91 GPR84 (0.64) GPR84SLC22A6GABRR1LMNAMAPT
SCHEMBL966415 0.85 GPR84 (0.74) GPR84SLC22A6GABRR1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008113190-A1 METHOD FOR THE PRODUCTION OF R-HYDROXYCARBOXYLIC ACIDS EMPA EIDGENÖSSISCHE MATERIALPRÜFUNGS- UND FORSCHUNGSANSTALT (CH) 2008-09-25 WO claimed
EP-1036190-B1 A METHOD FOR PRODUCING HYDROXYCARBOXYLIC ACIDS BY AUTO-DEGRADATION OF POLYHYDROXYALKANOATES CHIROBIO INC (KR) 2005-05-11 EP claimed
CN-1194098-C Method for producing hydroxycarboxylic acids by auto-degradation of polyhydroxyalkanoates KEROBIO LTD (KR) 2005-03-23 CN claimed
US-6472188-B1 SYNTHESIZING AND ACCUMULATING POLYHYDROXYALKANOATES (PHA) IN A CELL OF A MICROORGANISM BY CULTURING THE MICROORGANISM HAVING POLYHYDROXYALKANOATE DEPOLYMERASE ACTIVITY, COLLECTING CULTURED POLYMER, SUBJECTING TO MICROBIAL ENZYME DEGRADATION CHIROBIO INC. (KR) 2002-10-29 US claimed
CN-1301310-A Method for producing hydroxycarboxylic acid by self-degradation of polyhydroxyalkanoate KEROBIO LTD (KR) 2001-06-27 CN claimed
EP-1036190-A1 A METHOD FOR PRODUCING HYDROXYCARBOXYLIC ACIDS BY AUTO-DEGRADATION OF POLYHYDROXYALKANOATES ChiroBio Inc. (KR) 2000-09-20 EP claimed
WO-1999029889-A1 A METHOD FOR PRODUCING HYDROXYCARBOXYLIC ACIDS BY AUTO-DEGRADATION OF POLYHYDROXYALKANOATES LG CHEMICAL LTD. (KR) 1999-06-17 WO claimed
CN-102358747-B Rosuvastatin calcium intermediate and method for preparing rosuvastatin calcium intermediate and rosuvastatin calcium ZHEJIANG HONGYUAN PHARMACEUTICAL CO LTD 2012-09-19 CN disclosed
CN-102358747-A Rosuvastatin calcium intermediate and method for preparing rosuvastatin calcium intermediate and rosuvastatin calcium ZHEJIANG HONGYUAN PHARMACEUTICAL CO LTD 2012-02-22 CN disclosed
WO-2008113190-A1 METHOD FOR THE PRODUCTION OF R-HYDROXYCARBOXYLIC ACIDS EMPA EIDGENÖSSISCHE MATERIALPRÜFUNGS- UND FORSCHUNGSANSTALT (CH) 2008-09-25 WO disclosed
CN-1946855-A The method of making optically active ester derivatives and their acids from racemic esters ENZYTECH LTD (KR) 2007-04-11 CN disclosed
EP-1036190-B1 A METHOD FOR PRODUCING HYDROXYCARBOXYLIC ACIDS BY AUTO-DEGRADATION OF POLYHYDROXYALKANOATES CHIROBIO INC (KR) 2005-05-11 EP disclosed
CN-1194098-C Method for producing hydroxycarboxylic acids by auto-degradation of polyhydroxyalkanoates KEROBIO LTD (KR) 2005-03-23 CN disclosed
US-6472188-B1 SYNTHESIZING AND ACCUMULATING POLYHYDROXYALKANOATES (PHA) IN A CELL OF A MICROORGANISM BY CULTURING THE MICROORGANISM HAVING POLYHYDROXYALKANOATE DEPOLYMERASE ACTIVITY, COLLECTING CULTURED POLYMER, SUBJECTING TO MICROBIAL ENZYME DEGRADATION CHIROBIO INC. (KR) 2002-10-29 US disclosed
CN-1093126-C Improved process for the synthesis of protected esters of (s)-3,4-dihydroxytubyric acid WARNER LAMBERT CO (US) 2002-10-23 CN disclosed
CN-1301310-A Method for producing hydroxycarboxylic acid by self-degradation of polyhydroxyalkanoate KEROBIO LTD (KR) 2001-06-27 CN disclosed
EP-1036190-A1 A METHOD FOR PRODUCING HYDROXYCARBOXYLIC ACIDS BY AUTO-DEGRADATION OF POLYHYDROXYALKANOATES ChiroBio Inc. (KR) 2000-09-20 EP disclosed
CN-1223647-A Improved method for synthesizing protected -3, 4-dihydroxybutyrate ester WARNER LAMBERT CO (US) 1999-07-21 CN disclosed
WO-1999029889-A1 A METHOD FOR PRODUCING HYDROXYCARBOXYLIC ACIDS BY AUTO-DEGRADATION OF POLYHYDROXYALKANOATES LG CHEMICAL LTD. (KR) 1999-06-17 WO disclosed