SCHEMBL9320331

SCHEMBL9320331

Nc1ccc(S(=O)(=O)c2ccc(NC(=O)c3ccc(C(=O)Nc4ccc(S(=O)(=O)c5ccc(N)cc5)cc4)c(O)c3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 4/20 0.64
CA1 P00915 4/20 0.62
CA2 P00918 4/20 0.62
CA12 O43570 2/20 0.62
CA9 Q16790 2/20 0.62
SETD7 Q8WTS6 1/20 0.61
SNCA P37840 1/20 0.57
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
KMT2A Q03164 4/20 0.54
MEN1 O00255 3/20 0.54
PKM P14618 2/20 0.54
LMNA P02545 2/20 0.54
POLB P06746 1/20 0.54
APEX1 P27695 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
CYP2C19 P33261 1/20 0.54
KLKB1 P03952 1/20 0.53
HPGD P15428 1/20 0.52
TOP1 P11387 1/20 0.51

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
SCHEMBL9323417 0.90 SNCA (0.69) CA1CA2CA12CA9SNCA
SCHEMBL9321026 0.86 SNCA (0.63) PRMT1CA1CA2CA12CA9
SCHEMBL9321111 0.86 SNCA (0.63) CA1CA2CA12CA9SNCA
SCHEMBL9323419 0.83 SNCA (0.56) PRMT1CA1CA2CA12CA9
SCHEMBL9321085 0.83 KLKB1 (0.65) CA1CA2CA12CA9SNCA
SCHEMBL9323451 0.83 SNCA (0.58) CA1CA2CA12CA9SNCA
SCHEMBL9320403 0.83 BRAF (0.59) SNCAKMT2AMEN1PKMLMNA
SCHEMBL7048848 0.82 PRMT1 (0.81) PRMT1CA1CA2CA12CA9
SCHEMBL9320382 0.81 PRMT1 (0.69) PRMT1CA1CA2CA12CA9
SCHEMBL6315569 0.80 KLKB1 (0.77) SNCACYP3A4KMT2AMEN1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0387106-B1 Novel diamine compounds, production of the same and polyamideimide resins produced therefrom TOMOEGAWA PAPER CO LTD (JP) 1994-02-02 EP disclosed
US-5019642-A Novel diamine compounds, production of the same and polyamideimide resins produced therefrom TOMOEGAWA PAPER CO., LTD. (JP) 1991-05-28 US disclosed
EP-0387106-A1 Novel diamine compounds, production of the same and polyamideimide resins produced therefrom TOMOEGAWA PAPER CO. LTD. (JP) 1990-09-12 EP disclosed