SCHEMBL29640487

SCHEMBL29640487

CCCCCCCCCCCCCCCCCCCCCCC(COCCOCCO)OCCCCCCCCCCCC

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.61
THRB P10828 1/20 0.61
HTT P42858 1/20 0.61
KMT2A Q03164 1/20 0.61
MAPT P10636 1/20 0.61
LPAR1 Q92633 6/20 0.49
LPAR3 Q9UBY5 6/20 0.49
LPAR2 Q9HBW0 3/20 0.49
TSHR P16473 1/20 0.47
USP2 O75604 1/20 0.46
DNM1 Q05193 1/20 0.44
TLR2 O60603 3/20 0.44
LPAR6 P43657 2/20 0.42
LPAR4 Q99677 2/20 0.42
LPAR5 Q9H1C0 2/20 0.42

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
SCHEMBL31229949 1.00 MEN1 (0.61) MEN1THRBHTTKMT2AMAPT
SCHEMBL11038603 0.91 HTT (0.52) MEN1THRBHTTKMT2AMAPT
SCHEMBL8734209 0.91 HTT (0.52) MEN1THRBHTTKMT2AMAPT
SCHEMBL28061596 0.91 HTT (0.52) MEN1THRBHTTKMT2AMAPT
SCHEMBL8505229 0.90 HTT (0.67) MEN1THRBHTTKMT2AMAPT
SCHEMBL28769045 0.90 TSHR (0.55) MEN1THRBHTTKMT2AMAPT
SCHEMBL28061599 0.90 HTT (0.48) MEN1THRBHTTKMT2AMAPT
SCHEMBL9720217 0.88 MEN1 (0.51) MEN1THRBHTTKMT2AMAPT
SCHEMBL1628205 0.88 MEN1 (0.62) MEN1THRBHTTKMT2AMAPT
SCHEMBL5146487 0.88 MEN1 (0.62) MEN1THRBHTTKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114450366-A In-chip non-uniformities in planarization (WID-NU) 弗萨姆材料美国有限责任公司 2022-05-06 CN disclosed