SCHEMBL7196552

SCHEMBL7196552

CCCCCCCCc1cc(N)ccc1Nc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 7/20 0.50
ALDH1A1 P00352 7/20 0.50
TDP1 Q9NUW8 3/20 0.50
HTT P42858 3/20 0.50
ALOX15 P16050 1/20 0.50
MAPT P10636 7/20 0.43
KDM4E B2RXH2 6/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
NSD2 O96028 1/20 0.43
POLB P06746 1/20 0.43
APEX1 P27695 1/20 0.43
APOBEC3A P31941 1/20 0.43
RECQL P46063 1/20 0.43
CASP6 P55212 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
KCNH3 Q9ULD8 1/20 0.41
TLR8 Q9NR97 3/20 0.40
LMNA P02545 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40

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
SCHEMBL28260713 0.94 ALDH1A1 (0.53) GAAALDH1A1TDP1HTTALOX15
SCHEMBL6567725 0.88 GAA (0.56) GAAALDH1A1TDP1HTTALOX15
SCHEMBL30271883 0.85 GAA (0.62) GAAALDH1A1TDP1HTTALOX15
SCHEMBL4609634 0.82 ALDH1A1 (0.49) GAAALDH1A1TDP1HTTALOX15
SCHEMBL11208844 0.82 GAA (0.59) GAAALDH1A1TDP1HTTALOX15
SCHEMBL30040907 0.82 GAA (0.59) GAAALDH1A1TDP1HTTALOX15
SCHEMBL2493912 0.82 LIPG (0.50) GAAALDH1A1TDP1HTTMAPT
SCHEMBL31548023 0.82 LIPG (0.50) GAAALDH1A1TDP1HTTMAPT
SCHEMBL11213224 0.82 LIPG (0.50) GAAALDH1A1TDP1HTTMAPT
SCHEMBL11609802 0.82 LIPG (0.50) GAAALDH1A1TDP1HTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6515057-B1 Fluxed composites RHEIN CHEMIE CORPORATION 2003-02-04 US disclosed
US-6214913-B1 Fluxed composites RHEIN CHEMIE CORPORATION 2001-04-10 US disclosed
US-5621032-A Fluxed composites ELASTOCHEM, INC. (US) 1997-04-15 US disclosed
EP-0537006-A2 Fluxed composites ELASTOCHEM, INC. (US) 1993-04-14 EP disclosed
US-4312802-A POLYSTYRENE MATRIX WITH DISPERSION OF CROSSLINKED POLYBUTADIENE PARTICLES; IMPACT STRENGTH, CHEMICAL RESISTANCE UNITED STATES STEEL CORPORATION (US) 1982-01-26 US disclosed
US-4238407-A Process for the preparation of nitro diphenyl amine derivatives BAYER AKTIENGESELLSCHAFT (DE) 1980-12-09 US disclosed
US-4212789-A Process for preparing high impact polystyrenes UNITED STATES STEEL CORPORATION (US) 1980-07-15 US disclosed
US-4010255-A TRIDECADIENYL ACETATE CORNELL RESEARCH FOUNDATION, INC. (US) 1977-03-01 US disclosed