SCHEMBL6575209

SCHEMBL6575209

COC(CCCCCCN)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.42
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA3 P07451 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA5A P35218 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CA5B Q9Y2D0 2/20 0.42
TSHR P16473 2/20 0.42
LMNA P02545 1/20 0.42
BLM P54132 1/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.39
EPHX1 P07099 1/20 0.39
CPB2 Q96IY4 1/20 0.37

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
SCHEMBL6577127 1.00 DNM1 (0.42) DNM1CA12CA1CA2CA3
SCHEMBL6573289 0.97 NFKB1 (0.39) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL7420541 0.95 DNM1 (0.38) DNM1CA12CA1CA2CA3
SCHEMBL219409 0.89
Hydrochloric Acid SCHEMBL7420560 0.86 DNM1 (0.33) DNM1CA12CA1CA2CA3
Ammonia Solution, Strong SCHEMBL7766691 0.86 NFKB1 (0.32) DNM1CA12CA1CA2CA3
SCHEMBL7934687 0.86 SMPD1 (0.36)
SCHEMBL7936797 0.86 SMPD1 (0.36)
SCHEMBL7934735 0.86 SMPD1 (0.36)
SCHEMBL5160133 0.86 SMPD1 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0817776-B1 FORMALDEHYDE-FREE 1,3,5-TRIAZINE BASED CROSSLINKERS CYTEC TECH CORP (US) 2004-05-06 EP disclosed
US-5783642-A Coating compositions containing 1,3,5-triazine compounds substituted with acetal and/or cyclized acetal-based groups CYTEC INDUSTRIES INC. (US) 1998-07-21 US disclosed
US-5777040-A Curable compositions containing 1,3,5-triazine compounds substituted with acetal and/or cyclized acetal-based groups CYTEC TECHNOLOGY CORP. (US) 1998-07-07 US disclosed
EP-0817776-A1 FORMALDEHYDE-FREE 1,3,5-TRIAZINE BASED CROSSLINKERS CYTEC TECHNOLOGY CORP. (US) 1998-01-14 EP disclosed
US-5672703-A CURING AGENTS CYTEC TECHNOLOGY CORP. (US) 1997-09-30 US disclosed
WO-1996029318-A1 FORMALDEHYDE-FREE 1,3,5-TRIAZINE BASED CROSSLINKERS CYTEC TECHNOLOGY CORP. (US) 1996-09-26 WO disclosed