SCHEMBL7048899

SCHEMBL7048899

CCCC[C](O)CCCCO

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.58
TSHR P16473 5/20 0.55
ALDH1A1 P00352 4/20 0.55
LMNA P02545 2/20 0.55
HSD17B10 Q99714 2/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
GPR84 Q9NQS5 8/20 0.42
FFAR1 O14842 2/20 0.42
FFAR4 Q5NUL3 2/20 0.42
AKR1B1 P15121 1/20 0.42
PPARG P37231 6/20 0.40
PPARD Q03181 6/20 0.40
PPARA Q07869 6/20 0.40
HDAC11 Q96DB2 5/20 0.40
TLR2 O60603 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
FABP4 P15090 2/20 0.40
PTPN1 P18031 2/20 0.40
SLC22A6 Q4U2R8 1/20 0.40

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
SCHEMBL9355931 0.97 TSHR (0.60) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL5519538 0.92 TSHR (0.68) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL5518161 0.92 TSHR (0.68) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL6816127 0.92 TSHR (0.68) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL7980391 0.92 TSHR (0.68) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL5514816 0.92 TSHR (0.68) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL5519415 0.92 TSHR (0.68) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL5515745 0.92 TSHR (0.68) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL11516419 0.92 ALDH1A1 (0.56) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10
SCHEMBL19329177 0.89 SMN1; SMN2 (0.50) SMN1; SMN2TSHRALDH1A1LMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778712-B1 2-PROPYNYL ADENOSINE ANALOGS WITH MODIFIED 5'-RIBOSE GROUPS HAVING A2A AGONIST ACTIVITY Univ Virginia Patent Found (US) 2013-01-30 EP disclosed
WO-2003015706-A2 BORINIC ACID PROTEASE INHIBITORS WASHINGTON STATE UNIVERSITY RESEARCH FOUNDATION (US) 2003-02-27 WO disclosed