SCHEMBL5034793

SCHEMBL5034793

Oc1ccc2c(O)[c]ccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
ALOX15 P16050 3/20 0.37
HSD17B10 Q99714 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ESR1 P03372 8/20 0.35
ESR2 Q92731 8/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
HIF1A Q16665 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NQO2 P16083 1/20 0.34
TLR8 Q9NR97 1/20 0.34

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
SCHEMBL5034862 0.86 CYP1A2 (0.39) CYP1A2LMNAMEN1POLBKMT2A
SCHEMBL5031460 0.83 MCL1 (0.40) CYP1A2LMNAALOX15HSD17B10ESR1
SCHEMBL29212707 0.79 HSD17B10 (0.35) LMNAMEN1POLBKMT2AALOX15
SCHEMBL28433291 0.79 CYP1A2 (0.40) CYP1A2LMNAMEN1POLBKMT2A
SCHEMBL10708476 0.79 ESR1 (0.37) CYP1A2LMNAMEN1POLBKMT2A
SCHEMBL5032930 0.78 MCL1 (0.37) CYP1A2LMNAALOX15HSD17B10KDM4E
SCHEMBL6631398 0.74 ALDH1A1 (0.47) CYP1A2LMNAMEN1KMT2AHSD17B10
SCHEMBL4670596 0.74 LCK (0.36) CYP1A2LMNAMEN1POLBKMT2A
SCHEMBL1533447 0.73 CYP1A2 (0.57) CYP1A2LMNAMEN1POLBKMT2A
SCHEMBL533954 0.73 CYP1A2 (0.46) CYP1A2POLBHSD17B10KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080262127-A1 FLAME RESISTANT RESIN COMPOSITION CHANG CHUN PLASTICS CO., LTD. (TW) 2008-10-23 US disclosed
CN-1276035-C Water-color ink MITSUI CHEMICALS INC (JP) 2006-09-20 CN disclosed
CN-1558934-A Water-color ink 三井化学株式会社 2004-12-29 CN disclosed
US-20040231558-A1 Has a clear hue, high light fastness and high moisture resistance MITSUI CHEMICALS, INC. (JP) 2004-11-25 US disclosed
EP-1441013-A1 WATERCOLOR INK Mitsui Chemicals, Inc. (JP) 2004-07-28 EP disclosed