SCHEMBL4540287

SCHEMBL4540287

CC(O)CN(CC(C)O)c1ccc(C(=O)c2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.56
HPGD P15428 5/20 0.56
NPC1 O15118 2/20 0.56
ABCB1 P08183 1/20 0.49
ALDH1A1 P00352 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
HTT P42858 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SRD5A2 P31213 1/20 0.46
ELANE P08246 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MAPT P10636 2/20 0.44
GABRA1 P14867 1/20 0.42
GABRB1 P18505 1/20 0.42
CNR2 P34972 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PTGS1 P23219 2/20 0.42
PTGS2 P35354 2/20 0.42
CXCR1 P25024 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
SCHEMBL11570799 0.93 HPGD (0.50) RAB9AHPGDNPC1ABCB1ALDH1A1
SCHEMBL7145665 0.84 TAS2R14 (0.46) HPGDNPC1ALDH1A1SMN1; SMN2SRD5A2
SCHEMBL11570608 0.84 ALDH1A1 (0.42) RAB9AHPGDNPC1ABCB1ALDH1A1
SCHEMBL338524 0.82 POLB (0.44) ALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL12765216 0.80 HPGD (0.52) RAB9AHPGDNPC1ALDH1A1SMN1; SMN2
SCHEMBL51623 0.79 HPGD (0.63) RAB9AHPGDNPC1ALDH1A1SMN1; SMN2
Benzophenone SCHEMBL10489584 0.79 HPGD (0.63) RAB9AHPGDNPC1ALDH1A1SMN1; SMN2
SCHEMBL10637704 0.78 AKR1C3 (0.48) ABCB1ALDH1A1SMN1; SMN2NPSR1L3MBTL1
SCHEMBL11573734 0.78 ABCB1 (0.45) RAB9AHPGDNPC1ABCB1ALDH1A1
SCHEMBL9640951 0.77 ALDH1A1 (0.53) RAB9AHPGDNPC1ABCB1ALDH1A1

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2638076-B1 NOVEL PHOTOINITIATORS COLOPLAST AS (DK) 2018-03-28 EP claimed
US-9371308-B2 Polymeric photoinitiators COLOPLAST A/S (DK) 2016-06-21 US claimed
US-8946449-B2 Photoinitiators COLOPLAST A/S (DK) 2015-02-03 US claimed
EP-2638078-B1 NEW ROUTES TO POLYACRYLATES COLOPLAST AS (DK) 2015-01-07 EP claimed
EP-2638077-B1 NOVEL POLYMERIC PHOTOINITIATORS COLOPLAST AS (DK) 2015-01-07 EP claimed
EP-2744834-A1 POLYMERS COMPRISING PHOTOINITIATOR MOIETIES AND DYE MOIETIES Lambson Limited (GB) 2014-06-25 EP claimed
US-20130296577-A1 NOVEL PHOTOINITIATORS COLOPLAST A/S (DK) 2013-11-07 US claimed
US-20130296454-A1 ROUTES TO POLYACRYLATES COLOPLAST A/S (DK) 2013-11-07 US claimed
US-20130289155-A1 NOVEL POLYMERIC PHOTOINITIATORS COLOPLAST A/S (DK) 2013-10-31 US claimed
EP-2638076-A2 NOVEL PHOTOINITIATORS Coloplast A/S (DK) 2013-09-18 EP claimed
WO-2013026451-A1 POLYMERS COMPRISING PHOTOINITIATOR MOIETIES AND DYE MOIETIES COLOPLAST A/S (DK) 2013-02-28 WO claimed
WO-2012062332-A2 NOVEL PHOTOINITIATORS COLOPLAST A/S (DK) 2012-05-18 WO claimed
CN-110835397-B Self-crosslinking water-based photocuring polyurethane and preparation method and application thereof 江苏百赛飞生物科技有限公司 2021-12-31 CN disclosed
CN-109954169-B Coating composition, coating method and coated product 江苏百赛飞生物科技有限公司 2021-09-14 CN disclosed
CN-109957083-B Unsaturated polyol, photocurable polyurethane prepared from unsaturated polyol and preparation methods of unsaturated polyol and photocurable polyurethane 江苏百赛飞生物科技有限公司 2021-06-29 CN disclosed
CN-110819224-B Coating composition, protective coating based on coating composition and coated product 江苏百赛飞生物科技有限公司 2021-06-25 CN disclosed
EP-2638078-A1 NEW ROUTES TO POLYACRYLATES Coloplast A/S (DK) 2013-09-18 EP disclosed
WO-2013026451-A1 POLYMERS COMPRISING PHOTOINITIATOR MOIETIES AND DYE MOIETIES COLOPLAST A/S (DK) 2013-02-28 WO disclosed
WO-2012062334-A1 NEW ROUTES TO POLYACRYLATES COLOPLAST A/S (DK) 2012-05-18 WO disclosed
WO-2012062333-A1 NOVEL POLYMERIC PHOTOINITIATORS COLOPLAST A/S (DK) 2012-05-18 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130296577-A1 NOVEL PHOTOINITIATORS UROD, PUF60, PARG RAB9A 3656/4885HPGD 1150/4885NPC1 4393/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.