SCHEMBL2365059

SCHEMBL2365059

Cc1cc(C(C)(C)C)ccc1C(C)(OP(O)O)c1ccc(C(C)(C)C)cc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 2/20 0.35
RECQL P46063 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 3/20 0.35
TSHR P16473 1/20 0.34
CYP2D6 P10635 1/20 0.34
LMNA P02545 2/20 0.33
TYR P14679 1/20 0.33
ESR1 P03372 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
PDE2A O00408 1/20 0.32

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
SCHEMBL8390717 0.86 ALDH1A1 (0.38) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL9174361 0.77 NR1I2 (0.35) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL21288350 0.74 TSHR (0.48) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL39017 0.74 POLB (0.34) ALDH1A1TYRHTR1DHTR1BPOLB
SCHEMBL15225121 0.74 CNR2 (0.41) ESR1
SCHEMBL9328182 0.72 ALDH1A1 (0.36) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL5455454 0.72 POLB (0.33) HTR1DHTR1BPOLBCYP2C19
SCHEMBL187989 0.72 ALDH1A1 (0.36) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL339785 0.71
SCHEMBL10578704 0.71 CASR (0.33) ALDH1A1TDP1MAPTMEN1KMT2A

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
CN-112639034-A UV curable composition for 3D printing 巴斯夫欧洲公司 2021-04-09 CN disclosed
CN-112638968-A Photocurable composition for 3D printing 巴斯夫欧洲公司 2021-04-09 CN disclosed
EP-2534202-A1 POLYMER COMPOSITION Mitsubishi Chemical Europe GmbH (DE) 2012-12-19 EP disclosed
WO-2011095632-A1 POLYMER COMPOSITION MITSUBISHI CHEMICAL EUROPE GMBH (DE) 2011-08-11 WO disclosed
US-20060160915-A1 Photocurable compositions CIBA SPECIALTY CHEMCIALS CORP. 2006-07-20 US disclosed