SCHEMBL20245162

SCHEMBL20245162

CC(O)C(NC(=O)NC(N)=O)C(=O)NCCOCCOCC(=O)NC(CO)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ GLP1R P43220 8/20 0.33
▸ OPRM1 P35372 1/20 0.32
▸ OPRD1 P41143 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ PDCD1LG2 Q9BQ51 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31
▸ IL23R Q5VWK5 4/20 0.31
▸ TLR2 O60603 1/20 0.30

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
SCHEMBL20244998 1.00 SYK (0.39) SYKMEN1KMT2AGLP1ROPRM1
SCHEMBL20244990 0.90 HTT (0.39) SYKMEN1KMT2AGLP1RTLR2
SCHEMBL20245120 0.89 MEN1 (0.41) SYKMEN1KMT2APDCD1LG2CD274
SCHEMBL20244943 0.88 KMT2A (0.46) SYKMEN1KMT2AGLP1R
SCHEMBL18735833 0.88 PDCD1LG2 (0.43) SYKMEN1KMT2AGLP1ROPRM1
SCHEMBL18735832 0.88 PDCD1LG2 (0.43) SYKMEN1KMT2AGLP1ROPRM1
SCHEMBL18735831 0.88 PDCD1LG2 (0.43) SYKMEN1KMT2AGLP1ROPRM1
SCHEMBL20245180 0.87 MEN1 (0.43) SYKMEN1KMT2AGLP1ROPRM1
SCHEMBL20245027 0.87 SYK (0.41) SYKMEN1KMT2AGLP1ROPRM1
SCHEMBL20245161 0.87 SYK (0.41) SYKMEN1KMT2AGLP1ROPRM1

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
EP-3041468-B1 CYCLIC PEPTIDOMIMETIC COMPOUNDS AS IMMUNOMODULATORS AURIGENE DISCOVERY TECH LTD (IN) 2018-06-13 — — EP disclosed
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