SCHEMBL30931823

SCHEMBL30931823

COC(=O)c1cc(Oc2ccc(N3CCN(C(=O)OC(C)(C)C)CC3)nc2)cc(-c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 2/20 0.48
▸ ADK P55263 1/20 0.47
▸ PGK1 P00558 1/20 0.46
▸ RET P07949 12/20 0.45
▸ DDB1 Q16531 1/20 0.43
▸ CRBN Q96SW2 1/20 0.43
▸ CKS1B P61024 1/20 0.43
▸ SKP1 P63208 1/20 0.43
▸ SKP2 Q13309 1/20 0.43
▸ WNT3A P56704 1/20 0.43
▸ TBK1 Q9UHD2 1/20 0.41

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
SCHEMBL21551056 1.00 GPR119 (0.48) GPR119ADKPGK1RETDDB1
SCHEMBL29891232 1.00 GPR119 (0.48) GPR119ADKPGK1RETDDB1
SCHEMBL21551431 0.88 KMT2A (0.46) —
SCHEMBL21551215 0.88 FURIN (0.48) GPR119ADKPGK1RETDDB1
SCHEMBL29891361 0.88 FURIN (0.48) GPR119ADKPGK1RETDDB1
SCHEMBL30931809 0.88 FURIN (0.48) GPR119ADKPGK1RETDDB1
SCHEMBL27044993 0.87 GPR119 (0.54) GPR119ADKPGK1RETDDB1
SCHEMBL30931826 0.87 GPR119 (0.53) GPR119ADKPGK1RETDDB1
SCHEMBL29891789 0.87 GPR119 (0.53) GPR119ADKPGK1RETDDB1
SCHEMBL21551124 0.87 GPR119 (0.53) GPR119ADKPGK1RETDDB1

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-112384509-B Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-04-30 — — CN disclosed
Send feedback