SCHEMBL2804453

SCHEMBL2804453

O=C(O)c1ccc2c3ccc(C(=O)O)c4c(C(=O)OC(=O)c5ccc6c7cccc8c(C(=O)O)ccc(c9ccc(C(=O)O)c5c96)c87)ccc(c5cccc1c25)c43

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.47
TYMS P04818 1/20 0.45
PARP1 P09874 1/20 0.43
NR4A1 P22736 1/20 0.42
NR4A2 P43354 1/20 0.42
NR4A3 Q92570 1/20 0.42
KDM4E B2RXH2 6/20 0.40
L3MBTL1 Q9Y468 5/20 0.40
POLB P06746 4/20 0.40
ALDH1A1 P00352 4/20 0.40
KMT2A Q03164 3/20 0.40
CAMKK1 Q8N5S9 2/20 0.40
CAMKK2 Q96RR4 2/20 0.40
RECQL P46063 2/20 0.40
CASP6 P55212 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MEN1 O00255 2/20 0.40
MAPT P10636 2/20 0.40
CYP2D6 P10635 2/20 0.40
APOBEC3A P31941 1/20 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
SCHEMBL10350464 0.94 CYP1A2 (0.44) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL2173708 0.89 CYP1A2 (0.58) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL2434013 0.89 CYP1A2 (0.58) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL1189043 0.89 HSD17B10 (0.47) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL8989325 0.88 NR4A1 (0.50) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL200282 0.88 CYP1A2 (0.41) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL4256378 0.84 CYP1A2 (0.38) CYP1A2TYMSPARP1KDM4EALDH1A1
SCHEMBL28007 0.84 TYMS (0.58) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL28989 0.84 TYMS (0.58) CYP1A2TYMSPARP1NR4A1NR4A2
SCHEMBL29450078 0.84 TYMS (0.58) CYP1A2TYMSPARP1NR4A1NR4A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293847-B2 Film-like adhesive, adhesive sheet, and semiconductor device using same HITACHI CHEMICAL CO., LTD. (JP) 2012-10-23 US disclosed
US-20100239858-A1 FILM-LIKE ADHESIVE, ADHESIVE SHEET, AND SEMICONDUCTOR DEVICE USING SAME HITACHI CHEMICAL CO., LTD., (JP) 2010-09-23 US disclosed
EP-2053108-A1 FILM ADHESIVE, ADHESIVE SHEET, AND SEMICONDUCTOR DEVICE USING THE SAME Hitachi Chemical Co., Ltd. (JP) 2009-04-29 EP disclosed