SCHEMBL4580774

SCHEMBL4580774

CC(=O)C(C(=O)OC(=O)C(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1)C(O)(CC(=O)OC(=O)C(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1)C(=O)OC(=O)C(Cc1ccccc1)(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
ALDH1A1 P00352 3/20 0.36
RECQL P46063 1/20 0.36
MMP8 P22894 1/20 0.34
CTRB1 P17538 3/20 0.33
KCNH2 Q12809 2/20 0.32
OPRM1 P35372 2/20 0.32
OPRD1 P41143 2/20 0.32
MRGPRX2 Q96LB1 1/20 0.32
CHRM3 P20309 1/20 0.32
HRH2 P25021 1/20 0.32
HTR2A P28223 1/20 0.32
ADRA1A P35348 1/20 0.32
OPRK1 P41145 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PTPN1 P18031 2/20 0.31
PRSS1 P07477 2/20 0.31
CTSG P08311 2/20 0.31
CMA1 P23946 2/20 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
SCHEMBL4580780 0.84 TSHR (0.38) TSHRALDH1A1RECQLMMP8CTRB1
SCHEMBL28417040 0.73 ALDH1A1 (0.46) ALDH1A1OPRK1MEN1KMT2ACYP3A4
SCHEMBL242005 0.70 SLC13A5 (0.47) TSHRALDH1A1MEN1KMT2ACYP3A4
SCHEMBL28422148 0.69 ATM (0.41) ALDH1A1KMT2APRSS1
SCHEMBL4580777 0.68 ALDH1A1 (0.35) ALDH1A1RECQLMMP8KCNH2OPRM1
SCHEMBL11608822 0.64 TSHR (0.44) TSHRALDH1A1RECQLMMP8KCNH2
SCHEMBL5436754 0.64 ALDH1A1 (0.55) ALDH1A1MEN1KMT2APTPN1PTPRC
SCHEMBL11606111 0.63 ALDH1A1 (0.44) TSHRALDH1A1RECQLMMP8KCNH2
SCHEMBL7440048 0.63 KEAP1 (0.46) ALDH1A1RECQLMMP8ADRA1ACYP2C19
SCHEMBL28037957 0.62 SMN1; SMN2 (0.52) ALDH1A1RECQLMMP8CYP3A4CYP2C9

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-7407686-B2 Optical film, polarizing plate and display device utilising the film, and production method of optical film KONICA CORPORATION (JP) 2008-08-05 US disclosed
US-20060062936-A1 Optical film, polarizing plate and display device utilising the film, and production method of optical film KONICA CORPORATION 2006-03-23 US disclosed
US-20030170482-A1 Optical film, polarizing plate and display device utilizing the film, and production method of optical film KONICA CORPORATION (JP) 2003-09-11 US disclosed