SCHEMBL30392017

SCHEMBL30392017

CC(C)(C)OC(=O)NCCc1nnc(-c2ccc(I)cc2)nn1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.43
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 3/20 0.40
LATS1 O95835 2/20 0.40
NQO2 P16083 1/20 0.40
GFER P55789 1/20 0.39
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38

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
SCHEMBL22746305 0.88 ACACB (0.43) HTTALDH1A1TSHRPKMSMN1; SMN2
SCHEMBL25497384 0.87 CKS1B (0.47) HTTALDH1A1TSHRPKMSMN1; SMN2
SCHEMBL25497351 0.83 NAMPT (0.43) HTTALDH1A1TSHRPKMSMN1; SMN2
SCHEMBL26100199 0.80 TPMT (0.35) PKMSMN1; SMN2MAPTLMNAMEN1
SCHEMBL30392217 0.79 NAMPT (0.43) MAPTTDP1NPSR1LMNAGAA
SCHEMBL26097394 0.79 MTNR1A (0.39) ALDH1A1MAPTLMNA
SCHEMBL11961188 0.78 CA2 (0.55) HTTSMN1; SMN2MAPTTDP1NPSR1
SCHEMBL17976838 0.77 TDP1 (0.54) HTTALDH1A1TSHRPKMSMN1; SMN2
SCHEMBL25367309 0.77 NAMPT (0.47) MAPTTDP1NPSR1GAACA1
SCHEMBL26328902 0.75 MAPT (0.42) ALDH1A1SMN1; SMN2MAPTTDP1LMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4704904-A1 TETRAZINE-BASED TARGETING AGENTS FOR IN VIVO DELIVERY OF A PAYLOAD Tambo, Inc. (US) 2026-03-11 EP disclosed
WO-2025059685-A1 METHODS FOR IN VIVO TARGETED DELIVERY OF A PAYLOAD TAMBO, INC. (US) 2025-03-20 WO disclosed
WO-2024229427-A1 TETRAZINE-BASED TARGETING AGENTS FOR IN VIVO DELIVERY OF A PAYLOAD TAMBO, INC. (US) 2024-11-07 WO disclosed
EP-4422696-A1 TETRAZINE CONJUGATES FOR IN VIVO TARGETED DELIVERY OF A PAYLOAD Tambo, Inc. (US) 2024-09-04 EP disclosed
WO-2023077129-A1 TETRAZINE CONJUGATES FOR IN VIVO TARGETED DELIVERY OF A PAYLOAD TAMBO, INC. (US) 2023-05-04 WO disclosed