SCHEMBL2902800

SCHEMBL2902800

CCCCCCC(CCCC)C(=O)OCC(CC)CCCC

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.60
TSHR P16473 3/20 0.60
TDP1 Q9NUW8 2/20 0.60
ATM Q13315 1/20 0.60
PRSS1 P07477 1/20 0.57
PRSS2 P07478 1/20 0.57
PRSS3 P35030 1/20 0.57
RECQL P46063 1/20 0.54
CA2 P00918 6/20 0.53
ALDH1A1 P00352 4/20 0.53
CA1 P00915 2/20 0.49
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
MAPK1 P28482 2/20 0.47
HSD17B10 Q99714 1/20 0.47
ZDHHC7 Q9NXF8 1/20 0.46

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
SCHEMBL6239514 1.00 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL29195736 1.00 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL28957088 0.97 CYP3A4 (0.57) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL7223059 0.95 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL28900906 0.95 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL22501891 0.95 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL3747389 0.93 CA2 (0.52) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL3757070 0.93 CA2 (0.52) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL3745037 0.93 CA2 (0.52) CYP3A4TSHRTDP1ATMPRSS1
SCHEMBL20512290 0.93 CA2 (0.52) CYP3A4TSHRTDP1ATMPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3632994-B1 OIL-BASED INKJET INK RISO KAGAKU CORP (JP) 2024-01-24 EP claimed
US-20100322877-A1 SILICONE ELASTOMERS IN COSMETIC ESTERS ALZO INTERNATIONAL, INC. 2010-12-23 US claimed
EP-2211833-A2 SILICONE ELASTOMERS IN COSMETIC ESTERS Alzo International, Inc. (US) 2010-08-04 EP claimed
WO-2009054931-A2 SILICONE ELASTOMERS IN COSMETIC ESTERS ALZO INTERNATIONAL, INC. (US) 2009-04-30 WO claimed
EP-3632994-B1 OIL-BASED INKJET INK RISO KAGAKU CORP (JP) 2024-01-24 EP disclosed
CN-110776784-B Oil-based ink jet ink 理想科学工业株式会社 2022-09-09 CN disclosed
US-11414560-B2 Oil-based inkjet ink RISO KAGAKU CORPORATION (JP) 2022-08-16 US disclosed
CN-110776773-B Ink container and ink cartridge 理想科学工业株式会社 2022-05-10 CN disclosed
CN-110776783-B Oil-based inkjet ink set and printing method 理想科学工业株式会社 2022-03-22 CN disclosed
EP-3632994-A1 OIL-BASED INKJET INK Riso Kagaku Corporation (JP) 2020-04-08 EP disclosed
CN-110776783-A Oil-based inkjet ink set and printing method 理想科学工业株式会社 2020-02-11 CN disclosed
CN-110776773-A Ink container and ink cartridge 理想科学工业株式会社 2020-02-11 CN disclosed
CN-110776784-A Oil-based ink-jet ink 理想科学工业株式会社 2020-02-11 CN disclosed
US-20200040206-A1 OIL-BASED INKJET INK RISO KAGAKU CORPORATION (JP) 2020-02-06 US disclosed
US-20160194455-A1 Silicone Elastomer Gels and Related Hydrosilylation Processes ALZO INT INC (US) 2016-07-07 US disclosed
WO-2015048228-A2 IMPROVED SILICONE ELASTOMER GELS AND RELATED HYDROSILYLATION PROCESSES ALZO INTERNATIONAL, INC. (US) 2015-04-02 WO disclosed
WO-2012135281-A2 SILICONE CROSSLINKED UNSATURATED HYDROCARBON BASED POLYMERS ALZO INTERNATIONAL, INC. (US) 2012-10-04 WO disclosed
US-20100322877-A1 SILICONE ELASTOMERS IN COSMETIC ESTERS ALZO INTERNATIONAL, INC. 2010-12-23 US disclosed
EP-2211833-A2 SILICONE ELASTOMERS IN COSMETIC ESTERS Alzo International, Inc. (US) 2010-08-04 EP disclosed
WO-2009054931-A2 SILICONE ELASTOMERS IN COSMETIC ESTERS ALZO INTERNATIONAL, INC. (US) 2009-04-30 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 (2 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-20100322877-A1 SILICONE ELASTOMERS IN COSMETIC ESTERS CUTA, LAGE3, MMS19 CYP3A4 2729/4885TSHR 1711/4885TDP1 1418/4885
US-20160194455-A1 Silicone Elastomer Gels and Related Hydrosilylation Processes ITCH, MMS19, STS CYP3A4 3241/4885TSHR 3868/4885TDP1 2691/4885

“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.