SCHEMBL17011377

SCHEMBL17011377

CCOCC(=O)NCCOCCOCCOCCOCCOCCOCCOCCOCCn1cc(CNC(=O)[C@H]2CC[C@H](CN3C(=O)C=CC3=O)CC2)nn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTR P02766 1/20 0.56
▸ IL2 P60568 1/20 0.56
▸ F2RL1 P55085 1/20 0.33
▸ GBA1 P04062 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPK10 P53779 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PKM P14618 1/20 0.31
▸ DRD2 P14416 3/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31

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
SCHEMBL16994732 0.93 TTR (0.55) TTRIL2F2RL1GBA1OPRM1
SCHEMBL17874493 0.93 TTR (0.55) TTRIL2F2RL1GBA1OPRM1
SCHEMBL18772725 0.93 TTR (0.55) TTRIL2F2RL1GBA1OPRM1
SCHEMBL12342507 0.89 TTR (0.51) TTRIL2F2RL1OPRM1ALDH1A1
SCHEMBL30645075 0.85 TTR (0.52) TTRIL2F2RL1GBA1
SCHEMBL14129407 0.84 TTR (0.45) TTRIL2F2RL1GBA1OPRM1
SCHEMBL23425576 0.83 TTR (0.47) TTRIL2GBA1HPGDALDH1A1
SCHEMBL12342488 0.83 TTR (0.46) TTRIL2F2RL1OPRM1PKM
SCHEMBL13684272 0.83 TTR (0.46) TTRIL2F2RL1OPRM1PKM
SCHEMBL25559708 0.82 TTR (0.45) TTRIL2F2RL1GBA1OPRM1

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
US-9107960-B2 Antibody-SN-38 immunoconjugates with a CL2A linker IMMUNIMEDICS, INC. (US) 2015-08-18 — — US disclosed
Send feedback