SCHEMBL14001785

SCHEMBL14001785

CCCCC(C)C(=O)NCCCCCCN

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GNAI3 P08754 1/20 0.65
▸ GNAO1 P09471 1/20 0.65
▸ GNAI1 P63096 1/20 0.65
▸ RRM1 P23921 1/20 0.59
▸ SIRT6 Q8N6T7 1/20 0.58
▸ SIRT1 Q96EB6 1/20 0.58
▸ DPP7 Q9UHL4 2/20 0.57
▸ PAOX Q6QHF9 2/20 0.50
▸ TLR2 O60603 1/20 0.49
▸ SLC6A5 Q9Y345 2/20 0.47
▸ MMP8 P22894 1/20 0.45
▸ EPHX1 P07099 4/20 0.45
▸ CNR1 P21554 1/20 0.43

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
SCHEMBL20169779 0.93 GNAI3 (0.65) GNAI3GNAO1GNAI1RRM1SIRT6
SCHEMBL20169781 0.93 GNAI3 (0.65) GNAI3GNAO1GNAI1RRM1SIRT6
SCHEMBL20169776 0.93 GNAI3 (0.65) GNAI3GNAO1GNAI1RRM1SIRT6
SCHEMBL14627818 0.93 DPP7 (0.56) GNAI3GNAO1GNAI1RRM1SIRT6
SCHEMBL20073076 0.92 GNAI3 (0.62) GNAI3GNAO1GNAI1RRM1SIRT6
SCHEMBL28328772 0.90 DPP7 (0.62) GNAI3GNAO1GNAI1RRM1DPP7
SCHEMBL21467378 0.88 DPP7 (0.65) GNAI3GNAO1GNAI1RRM1DPP7
SCHEMBL23073481 0.86 GNAI3 (0.55) GNAI3GNAO1GNAI1RRM1SIRT6
SCHEMBL26756576 0.86 DPP7 (0.65) GNAI3GNAO1GNAI1RRM1SIRT6
SCHEMBL14874696 0.86 GNAI3 (0.58) GNAI3GNAO1GNAI1RRM1SIRT6

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
US-7445641-B1 Biomaterials modified with superoxide dismutase mimics PHARMACIA CORPORATION (US) 2008-11-04 — — US disclosed
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