SCHEMBL10010424

SCHEMBL10010424

CCCCC/C=C\C/C=C\CCCCCCCCC(O)(CCCCCCC/C=C\C/C=C\CCCCC)C(O)CCCCCCC/C=C\C/C=C\CCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
F7 P08709 3/20 0.45
F3 P13726 3/20 0.45
FABP3 P05413 3/20 0.45
PPARG P37231 2/20 0.45
PPARD Q03181 2/20 0.45
PPARA Q07869 2/20 0.45
DUSP3 P51452 1/20 0.45
PTPN7 P35236 1/20 0.45
FFAR1 O14842 1/20 0.45
LMNA P02545 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP19A1 P11511 1/20 0.45
FABP4 P15090 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
PTGS1 P23219 1/20 0.45
GNA15 P30679 1/20 0.45

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
SCHEMBL10010430 1.00 ALDH1A1 (0.45) ALDH1A1KDM4EF7F3FABP3
SCHEMBL10009115 1.00 ALDH1A1 (0.45) ALDH1A1KDM4EF7F3FABP3
SCHEMBL10009117 1.00 ALDH1A1 (0.45) ALDH1A1KDM4EF7F3FABP3
SCHEMBL15220042 0.87 FFAR1 (0.42) F7F3FABP3PPARGPPARD
SCHEMBL16534482 0.87 FFAR1 (0.42) F7F3FABP3PPARGPPARD
SCHEMBL3892975 0.86 ALDH1A1 (0.50) ALDH1A1HPGDTDP1
SCHEMBL19019739 0.85 ALDH1A1 (0.43) ALDH1A1KDM4EF7F3FABP3
SCHEMBL21192736 0.85 GPR84 (0.42) KDM4EFFAR1LMNACYP3A4
SCHEMBL28903645 0.85 GPR84 (0.42) KDM4EFFAR1LMNACYP3A4
SCHEMBL1735175 0.82 MAPT (0.46) ALDH1A1KDM4ELMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140288146-A1 NOVEL TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF PROTIVA BIOTHERAPEUTICS, INC. (CA) 2014-09-25 US disclosed
US-8466122-B2 Trialkyl cationic lipids and methods of use thereof PROTIVA BIOTHERAPEUTICS, INC. (CA) 2013-06-18 US disclosed
US-20120172411-A1 NOVEL TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF PROTIVA BIOTHERAPEUTICS, INC. (CA) 2012-07-05 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 (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-20140288146-A1 NOVEL TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF NPC1L1, LDLR, CETP ALDH1A1 4746/4885KDM4E 4459/4885F7 3898/4885
US-20120172411-A1 NOVEL TRIALKYL CATIONIC LIPIDS AND METHODS OF USE THEREOF NPC1L1, LDLR, CETP ALDH1A1 4746/4885KDM4E 4459/4885F7 3898/4885

“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.