SCHEMBL18759554

SCHEMBL18759554

CCC(=O)NCCCCCCNC(=O)c1cc(C(=O)NCCCOCCOCCOCCCNC(=O)CCCCC2SCC3NC(=O)NC32)cc(C(=O)NCCCOCCOCCOCCCNC(=O)CCCCC2SCC3NC(=O)NC32)c1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.62
▸ PRSS1 P07477 1/20 0.62
▸ PRSS2 P07478 1/20 0.62
▸ PRSS3 P35030 1/20 0.62
▸ TPSAB1 Q15661 1/20 0.62
▸ TDP1 Q9NUW8 2/20 0.56
▸ FOLH1 Q04609 3/20 0.55
▸ PKM P14618 2/20 0.54
▸ PLCD1 P51178 1/20 0.54
▸ L3MBTL3 Q96JM7 1/20 0.53
▸ CNR1 P21554 3/20 0.51
▸ CNR2 P34972 2/20 0.51
▸ HSP90AB1 P08238 1/20 0.51
▸ HPSE Q9Y251 1/20 0.51
▸ ITGB1 P05556 1/20 0.51
▸ ITGA4 P13612 1/20 0.51
▸ GIGYF2 Q6Y7W6 1/20 0.51

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
SCHEMBL10036981 0.93 F2 (0.62) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL18759543 0.92 TDP1 (0.58) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL10002270 0.90 F2 (0.58) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL10002255 0.90 F2 (0.59) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL18759549 0.90 TDP1 (0.57) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL21527938 0.89 F2 (0.57) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL18759856 0.89 PKM (0.57) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL29342020 0.88 F2 (0.63) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL1922409 0.88 F2 (0.56) F2PRSS1PRSS2PRSS3TPSAB1
SCHEMBL18760075 0.88 PRSS1 (0.55) F2PRSS1PRSS2PRSS3TPSAB1

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-10174363-B2 Methods for nucleic acid sequencing Quantum-Si Incorporated (US) 2019-01-08 — — US disclosed
US-20170107562-A1 METHODS FOR NUCLEIC ACID SEQUENCING Quantum-Si Incorporated (US) 2017-04-20 — — US disclosed
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