SCHEMBL8601794

SCHEMBL8601794

CCCNC(=O)C1CCC(CN)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
PLG P00747 3/20 0.50
PLAT P00750 1/20 0.50
NAAA Q02083 1/20 0.47
CHRNB2 P17787 1/20 0.47
CHRNB4 P30926 1/20 0.47
CHRNA3 P32297 1/20 0.47
CHRNA7 P36544 1/20 0.47
CHRNA4 P43681 1/20 0.47
GNAI3 P08754 2/20 0.44
GNAO1 P09471 2/20 0.44
GNAI1 P63096 2/20 0.44
ALDH1A1 P00352 2/20 0.44
PRSS1 P07477 2/20 0.44
PRSS2 P07478 2/20 0.44
PRSS3 P35030 2/20 0.44
PLAU P00749 1/20 0.44
KDM4E B2RXH2 2/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL8601792 1.00 LMNA (0.50) LMNAPLGPLATNAAACHRNB2
Hydrochloric Acid SCHEMBL3792018 0.98 LMNA (0.48) LMNAPLGPLATNAAACHRNB2
SCHEMBL8594845 0.91 NAAA (0.58) LMNAPLGPLATNAAAGNAI3
SCHEMBL8594847 0.91 NAAA (0.58) LMNAPLGPLATNAAAGNAI3
Hydrochloric Acid SCHEMBL8599841 0.90 NAAA (0.57) LMNAPLGPLATNAAAGNAI3
Hydrochloric Acid SCHEMBL8599842 0.90 NAAA (0.57) LMNAPLGPLATNAAAGNAI3
SCHEMBL8628590 0.87 NAAA (0.67) LMNAPLGNAAAGNAI3GNAO1
SCHEMBL8598693 0.87 NAAA (0.67) LMNAPLGNAAAGNAI3GNAO1
SCHEMBL8598695 0.87 NAAA (0.67) LMNAPLGNAAAGNAI3GNAO1
SCHEMBL8628588 0.87 NAAA (0.67) LMNAPLGNAAAGNAI3GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9713649-B2 PSMA-targeting imaging agents THE CLEVELAND CLINIC FOUNDATION (US) 2017-07-25 US disclosed
EP-0585130-B1 External preparation for skin containing a depigmentation agent SHISEIDO CO LTD (JP) 1998-01-28 EP disclosed
US-5690914-A TRANEXAMIC ACID DERIVATIVES FOR DEPIGMENTATION SHISEIDO CO., LTD (JP) 1997-11-25 US disclosed
EP-0585130-A2 External preparation for skin containing a depigmentation agent SHISEIDO COMPANY LIMITED (JP) 1994-03-02 EP disclosed