SCHEMBL19692691

SCHEMBL19692691

COCNC(=O)c1ccc2c(c1)CCN2C(=O)OC(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ LMNA P02545 6/20 0.48
▸ POLB P06746 1/20 0.47
▸ TP53 P04637 2/20 0.45
▸ THRB P10828 2/20 0.45
▸ GPR119 Q8TDV5 3/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ DHODH Q02127 1/20 0.42

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
SCHEMBL846218 0.83 HDAC1 (0.53) SMN1; SMN2TP53GPR119HDAC1HDAC6
SCHEMBL5077823 0.82 NR1H2 (0.61) HTTSMN1; SMN2LMNAHDAC1HDAC6
SCHEMBL1365222 0.82 ESR2 (0.62) HTTSMN1; SMN2LMNAHDAC1HDAC6
SCHEMBL19689700 0.81 GPR119 (0.47) SMN1; SMN2TP53GPR119DHODH
SCHEMBL30527088 0.81 DHODH (0.49) GPR119DHODH
SCHEMBL380505 0.81 DHODH (0.49) GPR119DHODH
SCHEMBL19689701 0.80 ALDH1A1 (0.51) SMN1; SMN2LMNAGPR119DHODH
SCHEMBL21724876 0.80 GPR119 (0.46) SMN1; SMN2GPR119HDAC1HDAC6DHODH
SCHEMBL30681278 0.79 GPR119 (0.45) GPR119DHODH
SCHEMBL30681279 0.78 DHODH (0.52) LMNATP53THRBGPR119HDAC1

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
EP-3468965-A1 1-TETRAHYDROPYRANYLCARBONYL-2,3-DIHYDRO-1H-INDOLE COMPOUNDS FOR TREATING CANCER Eli Lilly and Company (US) 2019-04-17 — — EP disclosed
WO-2017213919-A1 1-TETRAHYDROPYRANYLCARBONYL-2,3-DIHYDRO-1H-INDOLE COMPOUNDS FOR TREATING CANCER ELI LILLY AND COMPANY (US) 2017-12-14 — — WO disclosed
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