SCHEMBL896938

SCHEMBL896938

C=CC(NC(C)NC(CC)[Si](O)(O)O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.34
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MMP8 P22894 3/20 0.32
TRPA1 O75762 3/20 0.32
MMP9 P14780 3/20 0.31
HDAC3 O15379 4/20 0.31
HDAC4 P56524 4/20 0.31
HDAC1 Q13547 4/20 0.31
HDAC8 Q9BY41 4/20 0.31
HDAC6 Q9UBN7 4/20 0.31
HDAC7 Q8WUI4 3/20 0.31
HDAC2 Q92769 3/20 0.31
HDAC10 Q969S8 3/20 0.31
HDAC11 Q96DB2 3/20 0.31
HDAC9 Q9UKV0 3/20 0.31
HDAC5 Q9UQL6 3/20 0.31
MMP14 P50281 1/20 0.31

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
SCHEMBL145174 0.84 MMP8 (0.31) ALDH1A1MEN1KMT2AMMP8TRPA1
Hydrochloric Acid SCHEMBL28376502 0.83 HTT (0.31) MMP8TRPA1
SCHEMBL26104988 0.74 LMNA (0.33) ALDH1A1LMNAMEN1KMT2ATRPA1
SCHEMBL3675379 0.73 LMNA (0.33) ALDH1A1LMNAMMP8
SCHEMBL10989198 0.72 ADRA2C (0.41) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL9268820 0.71 SMN1; SMN2 (0.37) ALDH1A1LMNA
SCHEMBL6566164 0.71 MME (0.45) ALDH1A1LMNAPOLBMEN1KMT2A
Hydrochloric Acid SCHEMBL26908778 0.70 TAAR1 (0.38) ALDH1A1POLBMEN1KMT2A
SCHEMBL28933845 0.68 CYP2C19 (0.42) ALDH1A1LMNAKMT2AMMP8MMP9
Ammonia Solution, Strong SCHEMBL27951261 0.68 HDAC1 (0.39) ALDH1A1LMNAHDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120082791-A1 Coating Composition Amenable to Elastomeric Substrates LIVERSAGE ROBERT RICHARD (US) 2012-04-05 US claimed
US-20120082791-A1 Coating Composition Amenable to Elastomeric Substrates LIVERSAGE ROBERT RICHARD (US) 2012-04-05 US disclosed