SCHEMBL8433013

SCHEMBL8433013

O=C(O)CCCCCCCC(C(=O)O)C1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.46
ALDH1A1 P00352 1/20 0.43
TSHR P16473 2/20 0.42
LMNA P02545 2/20 0.42
HIF1A Q16665 2/20 0.42
HSD17B10 Q99714 1/20 0.42
EPHX2 P34913 1/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
KDM5A P29375 3/20 0.41
PHF8 Q9UPP1 3/20 0.41
KDM2A Q9Y2K7 3/20 0.41
KDM4C Q9H3R0 2/20 0.41
KDM4A O75164 1/20 0.41
GSTK1 Q9Y2Q3 1/20 0.41
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PTGER4 P35408 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
FFAR1 O14842 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
SCHEMBL774592 0.95 LMNA (0.43) EPHX1ALDH1A1TSHRLMNAHIF1A
SCHEMBL2403226 0.93 ALDH1A1 (0.46) EPHX1ALDH1A1TSHRLMNAHIF1A
SCHEMBL27940641 0.91 TSHR (0.46) ALDH1A1TSHRLMNAHSD17B10NFKB1
SCHEMBL27921928 0.91 TSHR (0.46) ALDH1A1TSHRLMNAHSD17B10NFKB1
SCHEMBL28494198 0.91 TSHR (0.46) ALDH1A1TSHRLMNAHSD17B10NFKB1
SCHEMBL27940658 0.91 TSHR (0.46) ALDH1A1TSHRLMNAHSD17B10NFKB1
SCHEMBL27921954 0.91 TSHR (0.46) ALDH1A1TSHRLMNAHSD17B10NFKB1
SCHEMBL28572076 0.85 ALDH1A1 (0.44) EPHX1ALDH1A1LMNAHIF1AEPHX2
SCHEMBL10494941 0.83 LCK (0.50) EPHX1TSHRHIF1AEPHX2CYP2C9
SCHEMBL181506 0.83 LCK (0.50) EPHX1TSHRHIF1AEPHX2CYP2C9

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
EP-0955998-A2 MICROPARTICLES CONTAINING ACTIVE SUBSTANCES, AGENTS CONTAINING THE SAME, THEIR USE IN ULTRASOUND-CONTROLLED RELEASING OF ACTIVE SUBSTANCES AS WELL AS THE METHOD FOR THEIR PRODUCTION SCHERING AKTIENGESELLSCHAFT (DE) 1999-11-17 EP claimed
WO-1998020856-A2 MICROPARTICLES CONTAINING ACTIVE SUBSTANCES, AGENTS CONTAINING THE SAME, THEIR USE IN ULTRASOUND-CONTROLLED RELEASING OF ACTIVE SUBSTANCES AS WELL AS THE METHOD FOR THEIR PRODUCTION SCHERING AKTIENGESELLSCHAFT (DE) 1998-05-22 WO claimed
WO-1998020904-A2 MICROPARTICLES FILLED WITH LIQUID ACTING ACCORDING TO A NEW PRINCIPLE AND THEIR USE AS DIAGNOSTIC AND THERAPEUTIC AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1998-05-22 WO claimed