SCHEMBL9238262

SCHEMBL9238262

O=C1c2ccc(OCCO)cc2C(=O)c2cc3ccccc3cc21

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
KMT2A Q03164 3/20 0.50
ALDH1A1 P00352 2/20 0.50
GAA P10253 2/20 0.50
MEN1 O00255 1/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CHRNA7 P36544 1/20 0.48
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA9 Q16790 1/20 0.48
RECQL P46063 1/20 0.47
PDK2 Q15119 1/20 0.46
PTPN1 P18031 1/20 0.45
ADORA2A P29274 1/20 0.45
POLB P06746 1/20 0.43
DNMT1 P26358 1/20 0.43
RAD52 P43351 1/20 0.43

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
SCHEMBL19126084 0.93 ALDH1A1 (0.53) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL11604758 0.92 MAPT (0.57) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL9429444 0.91 MAPT (0.51) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL31070279 0.84 ALK (0.50) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL6333882 0.84 ALK (0.50) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL6332215 0.84 ALK (0.50) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL6334182 0.84 ALK (0.50) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL5604043 0.83 MAPT (0.59) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL11796342 0.83 PNLIP (0.55) MAPTKMT2AALDH1A1GAAMEN1
SCHEMBL5605061 0.82 MAPT (0.51) MAPTKMT2AALDH1A1GAAMEN1

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
US-5391749-A Photoinitiators or photosensitizers CIBA-GEIGY CORPORATION (US) 1995-02-21 US disclosed
EP-0344109-B1 Substituted naphthacene-5,12-diones and their use CIBA GEIGY AG (CH) 1994-04-27 EP disclosed
US-5112977-A Photoinitiators, metallization of polymeric surfaces CIBA-GEIGY CORPORATION (US) 1992-05-12 US disclosed
US-4981962-A CHARGE TRANSFER COMPLEXES CIBA-GEIGY CORPORATION (US) 1991-01-01 US disclosed
EP-0344111-A2 Substituted tetrathio- and tetraselenotetracenes CIBA-GEIGY AG (CH) 1989-11-29 EP disclosed
EP-0344109-A2 Substituted naphthacene-5,12-diones and their use CIBA-GEIGY AG (CH) 1989-11-29 EP disclosed