SCHEMBL16675490

SCHEMBL16675490

CCNCCCCCN1CCN(N2CCCCC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.47
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
RAD52 P43351 1/20 0.38
KDM1A O60341 1/20 0.37
SCN5A Q14524 1/20 0.37
GNAI3 P08754 2/20 0.37
GNAO1 P09471 2/20 0.37
GNAI1 P63096 2/20 0.37
MEN1 O00255 1/20 0.35
GLA P06280 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PAOX Q6QHF9 1/20 0.35
SIGMAR1 Q99720 2/20 0.35
TSHR P16473 1/20 0.34
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT8 Q9NR22 1/20 0.34

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
SCHEMBL7326006 0.89 HRH3 (0.60) HRH3CYP2C19CYP1A2RAD52KDM1A
SCHEMBL13660804 0.87 HRH3 (0.52) HRH3CYP2C19CYP1A2RAD52SCN5A
SCHEMBL13178479 0.87 HRH3 (0.56) HRH3CYP2C19CYP1A2RAD52KDM1A
SCHEMBL13766333 0.85 HRH3 (0.52) HRH3CYP2C19CYP1A2RAD52KDM1A
SCHEMBL12612802 0.85 CYP2C19 (0.52) HRH3CYP2C19CYP1A2KDM1AGNAI3
SCHEMBL13661321 0.82 HRH3 (0.48) HRH3CYP2C19CYP1A2KDM1ASCN5A
SCHEMBL106752 0.82 PAOX (0.47) HRH3CYP2C19CYP1A2KDM1AGNAI3
SCHEMBL9120834 0.81 HRH3 (0.52) HRH3CYP2C19CYP1A2KDM1ASCN5A
SCHEMBL21727231 0.81 HRH3 (0.52) HRH3CYP2C19CYP1A2KDM1ASCN5A
SCHEMBL14479170 0.80 CYP2C19 (0.46) CYP2C19CYP1A2KDM1AGNAI3GNAO1

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
US-9429840-B2 Pattern forming method, composition used therein, method for manufacturing electronic device, and electronic device FUJIFILM CORPORATION (JP) 2016-08-30 US disclosed
US-20150118627-A1 PATTERN FORMING METHOD, COMPOSITION USED TEHREIN, METHOD FOR MANUFACTURING ELECTRONIC DEVICE, AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2015-04-30 US disclosed