SCHEMBL9575549

SCHEMBL9575549

CCCCOCC(COC(C)C)OCOC(COCCCC)COC(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.40
LPAR3 Q9UBY5 7/20 0.40
LPAR2 Q9HBW0 4/20 0.40
USP2 O75604 1/20 0.36
SPHK1 Q9NYA1 1/20 0.36
TSHR P16473 2/20 0.35
HTT P42858 1/20 0.35
PRKD3 O94806 1/20 0.35
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCH P24723 1/20 0.35
PRKCI P41743 1/20 0.35
PRKCE Q02156 1/20 0.35
PRKCQ Q04759 1/20 0.35
PRKCZ Q05513 1/20 0.35
PRKCD Q05655 1/20 0.35
PRKD1 Q15139 1/20 0.35
HSD17B10 Q99714 1/20 0.34
CYP3A4 P08684 2/20 0.34

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
SCHEMBL9575428 0.90 HSD17B10 (0.45) LPAR1LPAR3LPAR2USP2SPHK1
SCHEMBL9575523 0.89 LPAR1 (0.46) LPAR1LPAR3LPAR2USP2SPHK1
SCHEMBL18510371 0.82 LPAR1 (0.58) LPAR1LPAR3LPAR2USP2SPHK1
SCHEMBL9575515 0.81 LMNA (0.31)
SCHEMBL6988663 0.80
SCHEMBL2550954 0.78 LPAR1 (0.56) LPAR1LPAR3LPAR2USP2TSHR
SCHEMBL9575535 0.78 HSD17B10 (0.48) LPAR1LPAR3LPAR2USP2SPHK1
SCHEMBL9575740 0.78 HSD17B10 (0.35) LPAR1LPAR3LPAR2HSD17B10TDP1
SCHEMBL18510380 0.77 PRKD3 (0.60) LPAR1LPAR3LPAR2USP2SPHK1
SCHEMBL722046 0.76 TSHR (0.42) USP2SPHK1TSHRHTTCYP3A4

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
US-5225550-A PROCESS FOR THE PREPARATION OF SUBSTITUTED ACYCLIC NUCLEOSIDES, AND INTERMEDIATES OCCURRING THEREIN HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
EP-0464511-A2 Process for the preparation of acyclic, substituted nucleosides and its intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-08 EP disclosed