SCHEMBL9505644

SCHEMBL9505644

COCc1cc(C)c(COC)cc1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.43
PRKCE Q02156 3/20 0.43
MAPT P10636 3/20 0.43
MYLK Q15746 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
MEN1 O00255 1/20 0.43
PRKCG P05129 1/20 0.43
PRKCA P17252 1/20 0.43
APEX1 P27695 1/20 0.43
RECQL P46063 1/20 0.43
KMT2A Q03164 1/20 0.43
KCNA2 P16389 1/20 0.40
KCNA1 Q09470 1/20 0.40
LMNA P02545 2/20 0.39
HPGD P15428 6/20 0.37
HSD17B10 Q99714 5/20 0.37
KDM4E B2RXH2 3/20 0.37
GAA P10253 2/20 0.37
NPSR1 Q6W5P4 2/20 0.36
HSD17B3 P37058 1/20 0.36

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
SCHEMBL3194453 0.95 ALDH1A1 (0.40) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL10793829 0.92 ALDH1A1 (0.41) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL14703259 0.90 TDP1 (0.42) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL18848840 0.86 TAAR1 (0.46) ALDH1A1MAPTMEN1KMT2AHSD17B10
SCHEMBL12736232 0.84 NPSR1 (0.41) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL10039927 0.84 MAPT (0.39) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL10039920 0.84 ALDH1A1 (0.40) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL18500978 0.83 ALDH1A1 (0.41) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL9731686 0.81 ALDH1A1 (0.39) ALDH1A1PRKCEMAPTMYLKTDP1
SCHEMBL13879139 0.79 PRKCE (0.35) ALDH1A1PRKCEMAPTMYLKTDP1

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-0311387-B1 AROMATIC AMINE RESINS, THEIR PRODUCTION PROCESS AND THERMOSETTING RESIN COMPOSITIONS MAKING USE OF THE SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-08-11 EP disclosed
EP-0342943-B1 THERMOSETTING RESIN COMPOSITION MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-08-04 EP disclosed
US-5145949-A Production process for making aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1992-09-08 US disclosed
US-5106953-A Reacting aromatic amines with bishalogenomethyl derivatives; curing agents or raw materials for polyamides MITSUI TOATSU CHEMICALS, INC. (JP) 1992-04-21 US disclosed
US-5051494-A A bismaleimide and an amino resin MITSUI TOATSU CHEMICALS, INC. (JP) 1991-09-24 US disclosed
US-4959443-A HIGH STRENGTH, REACTION OF ARALKYL ALCOHOL AND AROMATIC AMINE MITSUI TOATSU CHEMICALS, INC. (JP) 1990-09-25 US disclosed
US-4937318-A Aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1990-06-26 US disclosed