SCHEMBL7912477

SCHEMBL7912477

CC(C)[C@@]1(C(=O)N[C@H](C)C(N)=O)CCCN1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MME P08473 1/20 0.33
RAB9A P51151 1/20 0.32
LTA4H P09960 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
SCHEMBL10771060 1.00 MME (0.33) MMERAB9ALTA4H
SCHEMBL9614199 0.73 CYP2D6 (0.36) MMELTA4H
SCHEMBL13715066 0.72 ARG1 (0.34)
SCHEMBL8016763 0.72 ARG1 (0.34)
SCHEMBL13715084 0.67 ARG1 (0.30)
SCHEMBL6051929 0.66 CYP2D6 (0.31)
SCHEMBL3665319 0.64 PARP1 (0.31)
SCHEMBL3665322 0.64 PARP1 (0.31)
SCHEMBL14534806 0.60
SCHEMBL8526197 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108779150-B Preparation method of degarelix and intermediate thereof 费森尤斯卡比依普莎姆责任有限公司 2022-03-29 CN disclosed
CN-108779150-A The Preparation Method And Their Intermediate of Ac-D-2Nal-D-4Cpa-D-3Pal-Ser-4Aph(Hor)-D-4Aph(Cbm)-Leu-Lys(iPr)-Pro-D-Ala-NH2 费森尤斯卡比依普莎姆责任有限公司 2018-11-09 CN disclosed
US-6214798-B1 POLYPEPTIDES FERRING BV (NL) 2001-04-10 US disclosed
EP-1003774-A1 GnRH ANTAGONISTS BEING MODIFIED IN POSITIONS 5 AND 6 FERRING B.V. (NL) 2000-05-31 EP disclosed
EP-0973801-A1 GnRH ANTAGONISTS FERRING B.V. (NL) 2000-01-26 EP disclosed
WO-1998046634-A1 GnRH ANTAGONISTS BEING MODIFIED IN POSITIONS 5 AND 6 FERRING B.V. (NL) 1998-10-22 WO disclosed
WO-1998046635-A1 GnRH ANTAGONISTS FERRING BV (NL) 1998-10-22 WO disclosed
WO-1997022622-A1 BETIDE-SUBSTITUTED GNRH ANTAGONISTS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1997-06-26 WO disclosed
EP-0500695-A1 GnRH ANALOGS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-09-02 EP disclosed
WO-1991006543-A1 GnRH ANALOGS THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1991-05-16 WO disclosed