SCHEMBL9814958

SCHEMBL9814958

CCC(C)OP(=O)(O)Cc1ccccc1OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
ALPG P10696 1/20 0.48
PTK2B Q14289 1/20 0.48
MME P08473 1/20 0.47
ACE P12821 1/20 0.47
CPA1 P15085 1/20 0.47
ACE2 Q9BYF1 1/20 0.47
HTR1A P08908 1/20 0.44
DRD2 P14416 1/20 0.44
PTPRC P08575 1/20 0.42
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
PTPRB P23467 1/20 0.42
PTPN6 P29350 1/20 0.42
PTPN11 Q06124 1/20 0.42
BRD4 O60885 1/20 0.42
CFD P00746 1/20 0.42
F11 P03951 1/20 0.42
TPSB2 P20231 1/20 0.42
PTGER1 P34995 2/20 0.41

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
SCHEMBL6254995 0.86 PTGER1 (0.48) PTGER1
SCHEMBL916790 0.84 L3MBTL1 (0.39) PTK2BBRD4MAPTL3MBTL1HPGD
SCHEMBL914481 0.84 L3MBTL1 (0.42) PTK2BBRD4MAPTL3MBTL1HPGD
SCHEMBL9171630 0.82 ALPG (0.36) GAAALPGPTK2BMMEACE
SCHEMBL1407856 0.81 TRPA1 (0.42) HPGDMEN1KMT2ACETP
SCHEMBL1011308 0.79 MME (0.49) MMEACECPA1ACE2PTPN2
SCHEMBL916315 0.78 TSHR (0.49) GAAHTR1AMEN1KMT2AMAPK1
SCHEMBL916701 0.77 KDM4E (0.36) HPGDKDM4EALDH1A1LMNA
SCHEMBL915190 0.76 FOLH1 (0.40) TDP1HPGDKDM4EMEN1ALDH1A1
SCHEMBL2008230 0.76 EPHX2 (0.36) HPGDKDM4E

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
EP-0295729-B1 INTRAMOLECULAR NUCLEOPHILIC DISPLACEMENT COMPOUND AND USE IN PHOTOGRAPHY AGFA-GEVAERT N.V. (BE) 1991-09-04 EP disclosed
US-4912028-A Alkali permeable hydrophilic colloid AGFA-GEVAERT, N.V. (BE) 1990-03-27 US disclosed
EP-0295729-A1 Intramolecular nucleophilic displacement compound and use in photography AGFA-GEVAERT N.V. (BE) 1988-12-21 EP disclosed