SCHEMBL7778435

SCHEMBL7778435

C=C(C)C(=O)C(N)C(C)O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 1/20 0.32
DPP4 P27487 2/20 0.30
DPP7 Q9UHL4 2/20 0.30
FAP Q12884 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
PREP P48147 1/20 0.30

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
SCHEMBL28813862 0.84 TDP1 (0.47) SLC7A5TDP1TSHRDPP4DPP7
Threonine SCHEMBL28147765 0.76 SLC7A5 (0.54) SLC7A5TDP1DPP4DPP7PREP
SCHEMBL12962497 0.76
SCHEMBL17706712 0.75 DPP4 (0.43) SLC7A5DPP4DPP7FAPDPP8
SCHEMBL29919566 0.74 SLC7A5 (0.38) SLC7A5TDP1DPP4DPP7PREP
Bromide SCHEMBL9580831 0.74
SCHEMBL20903952 0.73
SCHEMBL4282536 0.73
SCHEMBL1017270 0.73
SCHEMBL23748424 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0600062-B1 POLYMER-BOUND PACLITAXEL DERIVATIVES PHARMACIA & UPJOHN SPA (IT) 2001-09-19 EP disclosed
US-5569720-A WATER SOLUBLE; ANTITUMOR AGENTS FARMITALIA CARLO ERBA S.R.L. (IT) 1996-10-29 US disclosed
US-5362831-A Antitumor FARMITALIA CARLO ERBA S.R.L. (IT) 1994-11-08 US disclosed
EP-0600062-A1 POLYMER-BOUND PACLITAXEL DERIVATIVES PHARMACIA & UPJOHN S.p.A. (IT) 1994-06-08 EP disclosed
WO-1994000156-A1 POLYMER-BOUND PACLITAXEL DERIVATIVES PHARMACIA CARLO ERBA S.R.L. (IT) 1994-01-06 WO disclosed
CN-1079971-A The D51-7059 of polymer-bound FRAMITALIA CARLO ERBA S R L (IT) 1993-12-29 CN disclosed
CN-1058598-A NEW LINKER FOR BIOACTIVE AGENTS ERBA CARLO SPA (IT) 1992-02-12 CN disclosed