SCHEMBL10943641

SCHEMBL10943641

CCOC(OCC)C(=O)c1ccc2[nH]c3ccc(C(=O)C(OCC)OCC)cc3c(=O)c(=O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.48
▸ KDM4E B2RXH2 9/20 0.48
▸ MEN1 O00255 6/20 0.48
▸ KMT2A Q03164 6/20 0.48
▸ MAPT P10636 3/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ HCRTR1 O43613 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ HSD17B10 Q99714 7/20 0.47
▸ HPGD P15428 5/20 0.47
▸ MAPK1 P28482 4/20 0.47
▸ POLB P06746 2/20 0.47
▸ LMNA P02545 1/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ NPC1 O15118 2/20 0.43
▸ TP53 P04637 1/20 0.43
▸ GAA P10253 2/20 0.41
▸ TUBB4A P04350 1/20 0.41
▸ TUBB P07437 1/20 0.41
▸ TUBA3C P0DPH7 1/20 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
SCHEMBL10942642 0.97 ALDH1A1 (0.48) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10945023 0.93 KDM4E (0.55) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10946013 0.91 KDM4E (0.55) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10948788 0.79 NPC1 (0.48) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10944725 0.79 CYP1A2 (0.37) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10942256 0.78 KDM4E (0.42) ALDH1A1KDM4EMAPTSMN1; SMN2HSD17B10
SCHEMBL10941723 0.77 NPC1 (0.51) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10945783 0.77 ALDH1A1 (0.39) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL10944017 0.75 KDM4E (0.42) ALDH1A1KDM4EMAPTSMN1; SMN2HSD17B10
SCHEMBL11362698 0.75 CA12 (0.42) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4496447-A PHOTOPOLYMERIZATION OF UNSATURATED COMPOUNDS AND FOR CURING PRINTING INKS MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 1985-01-29 — — US disclosed
US-4374984-A Aromatic-aliphatic ketones useful as photoinitiators MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1983-02-22 — — US disclosed
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