SCHEMBL20100360

SCHEMBL20100360

C=C(C)C(=O)OCC(=O)NC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.56
ALDH1A1 P00352 4/20 0.46
LMNA P02545 3/20 0.46
RAB9A P51151 5/20 0.45
HDAC1 Q13547 2/20 0.45
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MEN1 O00255 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45
EPHX2 P34913 2/20 0.43
NR1H4 Q96RI1 2/20 0.43
ESRRG P62508 1/20 0.42
MAPK1 P28482 2/20 0.41
ALOX15 P16050 1/20 0.41
APEX1 P27695 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL20100440 0.88 ALDH1A1 (0.45) TDP1ALDH1A1LMNARAB9AHDAC1
SCHEMBL20100442 0.84 ATM (0.55) TDP1ALDH1A1RAB9AMAPTSMN1; SMN2
SCHEMBL20100374 0.76 HDAC1 (0.56) ALDH1A1LMNARAB9AHDAC1MAPT
SCHEMBL24241673 0.75 RAB9A (0.57) TDP1ALDH1A1LMNARAB9AHDAC1
SCHEMBL28941993 0.74 MAPT (0.50) TDP1ALDH1A1LMNARAB9AHDAC1
SCHEMBL24534904 0.74 HDAC1 (0.55) TDP1ALDH1A1LMNARAB9AHDAC1
SCHEMBL20100388 0.74 HDAC1 (0.44) ALDH1A1LMNARAB9AHDAC1MAPT
SCHEMBL10234475 0.73 SMN1; SMN2 (0.48) ALDH1A1LMNARAB9AMAPTSMN1; SMN2
SCHEMBL14867062 0.73 MEN1 (0.50) ALDH1A1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL5690964 0.73 HDAC1 (0.72) ALDH1A1LMNARAB9AHDAC1MAPT

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-10042259-B2 Topcoat compositions and pattern-forming methods ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2018-08-07 US disclosed
US-20180118970-A1 TOPCOAT COMPOSITIONS AND PATTERN-FORMING METHODS ROHM AND HAAS ELECTRONIC MATERIALS LLC 2018-05-03 US disclosed