SCHEMBL22430596

SCHEMBL22430596

CCCCCCCCC1C(CCCCCCCCN)CCC(CCCCCCCCN)C1CCCCCC

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 8/20 0.52
▸ EPHX1 P07099 2/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ SIGMAR1 Q99720 1/20 0.41
▸ ALOX5 P09917 1/20 0.38
▸ CHRNB2 P17787 1/20 0.35
▸ CHRNA7 P36544 1/20 0.35
▸ CHRNA4 P43681 1/20 0.35
▸ CYP1A2 P05177 2/20 0.33

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
SCHEMBL25634185 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL8008911 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL19781307 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL28669434 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL24200090 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL19754911 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL25473072 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL22454430 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL22571487 1.00 DNM1 (0.52) DNM1EPHX1ALDH1A1MEN1KMT2A
SCHEMBL27108264 0.92 DNM1 (0.41) DNM1EPHX1ALDH1A1MEN1KMT2A

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-20220177651-A1 CROSSLINKABLE SILOXANE COMPOUNDS FOR THE PREPARATION OF DIELECTRIC MATERIALS MERCK PATENT GMBH (DE) 2022-06-09 — — US disclosed
WO-2020182636-A1 CROSSLINKABLE SILOXANE COMPOUNDS FOR THE PREPARATION OF DIELECTRIC MATERIALS MERCK PATENT GMBH (DE) 2020-09-17 — — WO disclosed
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