SCHEMBL7582358

SCHEMBL7582358

NCCCCCCC[CH]CCCCCCCCCCCCN

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 9/20 0.57
CA12 O43570 2/20 0.57
CA1 P00915 2/20 0.57
CA2 P00918 2/20 0.57
CA3 P07451 2/20 0.57
CA4 P22748 2/20 0.57
CA6 P23280 2/20 0.57
CA5A P35218 2/20 0.57
CA7 P43166 2/20 0.57
CA9 Q16790 2/20 0.57
CA14 Q9ULX7 2/20 0.57
CA5B Q9Y2D0 2/20 0.57
TSHR P16473 2/20 0.57
LMNA P02545 1/20 0.57
BLM P54132 1/20 0.57
NFKB1 P19838 1/20 0.50
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.42
EPHX1 P07099 1/20 0.42

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
SCHEMBL8672908 1.00 DNM1 (0.57) DNM1CA12CA1CA2CA3
SCHEMBL6545426 1.00 DNM1 (0.57) DNM1CA12CA1CA2CA3
SCHEMBL8602344 1.00 DNM1 (0.57) DNM1CA12CA1CA2CA3
SCHEMBL10585256 1.00 DNM1 (0.57) DNM1CA12CA1CA2CA3
SCHEMBL8670580 1.00 DNM1 (0.57) DNM1CA12CA1CA2CA3
SCHEMBL7373662 0.93 NFKB1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL6560896 0.86 DNM1 (0.68) DNM1CA12CA1CA2CA3
SCHEMBL7610794 0.86 DNM1 (0.68) DNM1CA12CA1CA2CA3
SCHEMBL10426271 0.86 DNM1 (0.68) DNM1CA12CA1CA2CA3
SCHEMBL8158097 0.86 DNM1 (0.68) DNM1CA12CA1CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1108001-A1 PIGMENT COMPOSITIONS CONTAINING SUBSTITUTED AMIDO PHTHALOCYANINE DERIVATIVES Ciba SC Holding AG (CH) 2001-06-20 EP claimed
WO-2000012633-A1 PIGMENT COMPOSITIONS CONTAINING SUBSTITUTED AMIDO PHTHALOCYANINE DERIVATIVES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2000-03-09 WO claimed
EP-1108000-B1 PROCESS FOR THE PREPARATION OF SUBSTITUTED AMIDO PHTHALOCYANINE DERIVATIVES AND SUBSTITUTED AMIDO PHTHALOCYANINE DERIVATIVES CIBA SC HOLDING AG (CH) 2002-10-09 EP disclosed
EP-1108001-B1 USE OF PIGMENT COMPOSITIONS CONTAINING SUBSTITUTED AMIDO PHTHALOCYANINE DERIVATIVES IN A THERMOPLASTIC RESIN COMPOSITION CIBA SC HOLDING AG (CH) 2002-10-02 EP disclosed
US-6284031-B1 AS FLOW CONTROL, NONFLOCCULATING AGENTS AND HEAT STABILIZERS; INKS, PAINTS, THERMOPLASTIC RESINS CIBA SPECIALTY CHEMICALS CORP. 2001-09-04 US disclosed
US-6123761-A FOR IMPARTING FLOW PROPERTIES IN INK AND PAINT COATINGS AND HEAT STABILIZING PROPERTIES IN THERMOPLASTIC RESINS CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-09-26 US disclosed
US-6124451-A Process for the preparation of substituted amido phthalocyanine derivatives and novel substituted amido phthalocyanine derivatives CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-09-26 US disclosed