SCHEMBL15047433

SCHEMBL15047433

CC(CO)N1CC[C@@H](C)C1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.38
SIGMAR1 Q99720 4/20 0.36
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
ESR2 Q92731 6/20 0.33
ESR1 P03372 2/20 0.33
KDM4E B2RXH2 1/20 0.33
PHGDH O43175 1/20 0.32
MGLL Q99685 1/20 0.32

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
SCHEMBL14855774 1.00 HRH3 (0.38) HRH3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL14856258 1.00 HRH3 (0.38) HRH3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL5998295 1.00 HRH3 (0.38) HRH3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL14915000 1.00 HRH3 (0.38) HRH3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL806361 1.00 HRH3 (0.38) HRH3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL5995166 1.00 HRH3 (0.38) HRH3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL5971686 1.00 HRH3 (0.38) HRH3SIGMAR1MEN1ALDH1A1KMT2A
SCHEMBL26446019 0.88 KDM4E (0.41) HRH3MEN1ALDH1A1KMT2AKDM4E
SCHEMBL26433911 0.88 KDM4E (0.41) HRH3MEN1ALDH1A1KMT2AKDM4E
SCHEMBL26433881 0.88 KDM4E (0.41) HRH3MEN1ALDH1A1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107531722-B Heterocyclic estrogen receptor modulators and uses thereof 豪夫迈·罗氏有限公司 2020-07-17 CN disclosed
WO-2013090829-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ARAGON PHARMACEUTICALS, INC. (US) 2013-06-20 WO disclosed