SCHEMBL25128374

SCHEMBL25128374

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)NCCCC[C@@H](NC(=O)CCC(C)C)C(=O)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.43
▸ TSHR P16473 1/20 0.40
▸ BRD4 O60885 3/20 0.37
▸ NMT2 O60551 1/20 0.34
▸ NMT1 P30419 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ FOLH1 Q04609 2/20 0.33
▸ NOD1 Q9Y239 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL27312935 1.00 GLP1R (0.43) GLP1RTSHRBRD4NMT2NMT1
SCHEMBL25128368 1.00 GLP1R (0.43) GLP1RTSHRBRD4NMT2NMT1
SCHEMBL27312248 1.00 GLP1R (0.43) GLP1RTSHRBRD4NMT2NMT1
SCHEMBL25129007 1.00 GLP1R (0.43) GLP1RTSHRBRD4NMT2NMT1
SCHEMBL25128376 0.93 GLP1R (0.46) GLP1RTSHRNMT2NMT1HPGD
SCHEMBL25128854 0.91 GLP1R (0.48) GLP1RNMT2NMT1HPGDFOLH1
SCHEMBL25128369 0.90 GLP1R (0.49) GLP1RTSHRNOD1
SCHEMBL25128967 0.88 GLP1R (0.41) GLP1RTSHRBRD4HPGDKDM4E
SCHEMBL25128366 0.88 GLP1R (0.45) GLP1RTSHRBRD4NMT2NMT1
SCHEMBL25128579 0.88 GLP1R (0.45) GLP1RTSHRBRD4NMT2NMT1

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
WO-2023040793-A1 ANTI-INFLAMMATORY COMPOUND AND USE THEREOF 映恩生物制药(苏州)有限公司 2023-03-23 — — WO disclosed
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