SCHEMBL28078036

SCHEMBL28078036

CN1CCC(N2CCNCC2)CC1.NN1CCN(CCO)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
ACHE P22303 1/20 0.31
PHGDH O43175 1/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 2/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL3 Q96JM7 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PKM P14618 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
SCHEMBL21367143 0.83 SLC18A3 (0.40) GNAI3GNAO1GNAI1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL27178798 0.81 SMN1; SMN2 (0.40) GNAI3GNAO1GNAI1ALDH1A1KDM4E
SCHEMBL5659414 0.81 ALDH1A1 (0.41) GNAI3GNAO1GNAI1ACHEALDH1A1
SCHEMBL23269644 0.80 L3MBTL1 (0.40) ACHEALDH1A1KDM4EKMT2ASMN1; SMN2
SCHEMBL23269705 0.78 ALDH1A1 (0.38) GNAI3GNAO1GNAI1ALDH1A1KDM4E
SCHEMBL105570 0.78 HTR6 (0.43) PHGDHALDH1A1KMT2AHPGDSMN1; SMN2
SCHEMBL23269702 0.77 KDM4E (0.37) GNAI3GNAO1GNAI1ALDH1A1KDM4E
SCHEMBL2226268 0.76 KDM4E (0.39) GNAI3GNAO1GNAI1ALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL19410299 0.76 HTR6 (0.42) PHGDHALDH1A1KMT2AHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL6684458 0.76 SMN1; SMN2 (0.46) GNAI3GNAO1GNAI1PHGDHALDH1A1

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
CN-104046246-B The chemical-mechanical planarization of tungsten-containing substrate 气体产品与化学公司 2016-06-15 CN disclosed