SCHEMBL9601232

SCHEMBL9601232

C=CC(=O)OCCOc1ccccc1C(CC)c1ccccc1OCCOC(=O)C=C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.58
THRA P10827 1/20 0.41
TSHR P16473 3/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 6/20 0.40
CYSLTR2 Q9NS75 2/20 0.40
CYSLTR1 Q9Y271 2/20 0.40
TP53 P04637 2/20 0.40
HIF1A Q16665 2/20 0.40
KMT2A Q03164 2/20 0.40
PTK2B Q14289 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPSR1 Q6W5P4 3/20 0.39
KDM4E B2RXH2 2/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
MAPT P10636 1/20 0.38
GLA P06280 1/20 0.38
MEN1 O00255 1/20 0.37

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
SCHEMBL10437471 0.86 THRB (0.57) THRBTHRATSHRALDH1A1TP53
SCHEMBL28121765 0.84 THRB (0.62) THRBTHRATSHRHPGDALDH1A1
SCHEMBL9574930 0.84 THRB (0.55) THRBTHRATSHRHPGDALDH1A1
SCHEMBL12835864 0.84 THRB (0.42) THRBTHRAALDH1A1CYSLTR2CYSLTR1
SCHEMBL3765443 0.82 THRB (0.52) THRBTHRATSHRHPGDALDH1A1
SCHEMBL28297685 0.81 THRB (0.52) THRBTHRATSHRHPGDALDH1A1
SCHEMBL6271212 0.81 THRB (0.43) THRBTSHRALDH1A1CYSLTR2CYSLTR1
SCHEMBL1248606 0.79 THRB (0.67) THRBTSHRHPGDALDH1A1TP53
SCHEMBL29670509 0.79 THRB (0.67) THRBTSHRHPGDALDH1A1TP53
SCHEMBL1828411 0.79 THRB (0.62) THRBTSHRALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0305545-B1 SUBSTITUTED ACRIDINE DERIVATIVES AND THEIR USE Hitachi Chemical Co., Ltd. (JP) 1993-02-10 EP disclosed
US-5089377-A Acridin-9-yl acrylates ASAHI DENKA KOGYO K.K. (JP) 1992-02-18 US disclosed
US-5045433-A Photopolymerization initiators HITACHI CHEMICAL CO., LTD. (JP) 1991-09-03 US disclosed
US-4985564-A Acridine compound and photopolymerizable composition using the same HITACHI CHEMICAL CO., LTD. (JP) 1991-01-15 US disclosed
EP-0360443-A1 Acridine compound and photopolymerizable composition using the same Hitachi Chemical Co., Ltd. (JP) 1990-03-28 EP disclosed
EP-0305545-A1 SUBSTITUTED ACRIDINE DERIVATIVES AND THEIR USE Hitachi Chemical Co., Ltd. (JP) 1989-03-08 EP disclosed