SCHEMBL6367297

SCHEMBL6367297

O=C(O)CCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCCOCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.67
LMNA P02545 3/20 0.67
NFKB1 P19838 1/20 0.67
PMP22 Q01453 1/20 0.67
ALDH1A1 P00352 4/20 0.65
GPR84 Q9NQS5 8/20 0.55
FFAR1 O14842 2/20 0.55
FFAR4 Q5NUL3 2/20 0.55
SLC22A6 Q4U2R8 2/20 0.53
PPARG P37231 6/20 0.52
PPARD Q03181 6/20 0.52
PPARA Q07869 6/20 0.52
HDAC11 Q96DB2 5/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
MEN1 O00255 2/20 0.52
FABP4 P15090 2/20 0.52
ALOX15 P16050 2/20 0.52
PTPN1 P18031 2/20 0.52
KMT2A Q03164 2/20 0.52

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
SCHEMBL6900636 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL7748806 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL6901628 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL6900744 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL6899202 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL6902041 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL6901617 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL9661395 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL21357404 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1
SCHEMBL2275936 1.00 TSHR (0.67) TSHRLMNANFKB1PMP22ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6852686-B2 Methods for ameliorating icthyosiform skin diseases THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-02-08 US disclosed
US-20030072795-A1 Methods for ameliorating icthyosiform skin diseases GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES, THE 2003-04-17 US disclosed
WO-2000078937-A1 METHODS FOR AMELIORATING ICTHYOSIFORM SKIN DISEASES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, ASREPRESENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2000-12-28 WO disclosed