SCHEMBL20580485

SCHEMBL20580485

CCCCC(N)(CCCC)CCCC.CCOC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.39
ALOX15 P16050 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
AKR1B1 P15121 1/20 0.37
PAM P19021 2/20 0.36
ALDH1A1 P00352 3/20 0.36
GPR84 Q9NQS5 7/20 0.35
PPARG P37231 7/20 0.35
PPARD Q03181 7/20 0.35
PPARA Q07869 7/20 0.35
HDAC11 Q96DB2 5/20 0.35
TSHR P16473 4/20 0.35
PTPN1 P18031 3/20 0.35
TLR2 O60603 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
FABP4 P15090 2/20 0.35

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
SCHEMBL5993967 0.92 MEN1 (0.46) FDPSALOX15MEN1KMT2AMAPT
SCHEMBL2230483 0.83 FDPS (0.42) FDPSALOX15MEN1KMT2AAKR1B1
Bicarbonate SCHEMBL4357070 0.83 FDPS (0.48) FDPSALOX15MEN1KMT2AAKR1B1
Acetic Acid SCHEMBL2529015 0.81 FDPS (0.46) FDPSALOX15MEN1KMT2AAKR1B1
Hexane SCHEMBL8017946 0.80 AKR1B1 (0.48) ALOX15MEN1KMT2AAKR1B1PAM
SCHEMBL28714419 0.79 SMPD1 (0.46) FDPSMEN1KMT2AMAPTATM
SCHEMBL28558128 0.78 GPR84 (0.50) ALOX15MEN1KMT2AAKR1B1PAM
SCHEMBL20580390 0.77 LMNA (0.43) FDPSALOX15MEN1KMT2AAKR1B1
Butylamine SCHEMBL18173554 0.77 CYP1A2 (0.54) ALOX15MEN1KMT2AALDH1A1TSHR
Pivalate SCHEMBL4924833 0.77 FDPS (0.43) FDPSALOX15MEN1KMT2AAKR1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3638417-B1 COATING SYSTEM ELEMENTIS SPECIALTIES INC (US) 2022-10-12 EP disclosed
US-20210108088-A1 COATING SYSTEM ELEMENTIS SPECIALTIES, INC. (US) 2021-04-15 US disclosed
US-10894886-B2 Coating system ELEMENTIS SPECIALTIES, INC. (US) 2021-01-19 US disclosed
EP-3638417-A1 COATING SYSTEM Elementis Specialties, Inc. (US) 2020-04-22 EP disclosed
CN-110958913-A Coating system 海名斯精细化工公司 2020-04-03 CN disclosed
WO-2018231922-A1 COATING SYSTEM ELEMENTIS SPECIALTIES, INC. (US) 2018-12-20 WO disclosed
WO-2018231920-A1 NAIL COLOR COATING SYSTEM ELEMENTIS SPECIALTIES, INC. (US) 2018-12-20 WO disclosed
US-20180353400-A1 NAIL COLOR COATING SYSTEM ELEMENTIS SPECIALTIES, INC. (US) 2018-12-13 US 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-20180353400-A1 NAIL COLOR COATING SYSTEM POLR1C, NACA, ETF1 FDPS 4824/4885ALOX15 4757/4885MEN1 2710/4885

“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.