SCHEMBL1702131

SCHEMBL1702131

CCCC(O)CCC(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.39
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
FDPS P14324 1/20 0.33
TSHR P16473 2/20 0.32
LMNA P02545 1/20 0.31
FFAR4 Q5NUL3 1/20 0.30
FFAR1 O14842 1/20 0.30

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
SCHEMBL8896856 0.89 RIPK1 (0.44) RIPK1ACACBACACATSHR
SCHEMBL7404026 0.85 FFAR4 (0.41) RIPK1ACACBACACAFDPSFFAR4
SCHEMBL8388721 0.83 ACACB (0.48) RIPK1ACACBACACAFDPSFFAR4
SCHEMBL8641193 0.83 FFAR4 (0.48) ACACBACACAFDPSFFAR4FFAR1
SCHEMBL15855762 0.83 FDPS (0.43) FDPSTSHRLMNAFFAR4FFAR1
SCHEMBL29232764 0.83 FDPS (0.43) FDPSTSHRLMNAFFAR4FFAR1
SCHEMBL1328891 0.83 FDPS (0.43) FDPSTSHRLMNAFFAR4FFAR1
SCHEMBL28568549 0.83 FDPS (0.43) FDPSTSHRLMNAFFAR4FFAR1
SCHEMBL30575792 0.83 FDPS (0.43) FDPSTSHRLMNAFFAR4FFAR1
SCHEMBL7787347 0.82 ALDH1A1 (0.43) ACACBACACAFDPSTSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108531315-A A kind of adult's liquid detergent containing licorice 内蒙古伊草恋生物科技有限责任公司 2018-09-14 CN disclosed
EP-2588246-A1 PROCESS FOR PREPARING A THIXOTROPING AGENT AND USE THEREOF Construction Research & Technology GmbH (DE) 2013-05-08 EP disclosed
WO-2012000774-A1 PROCESS FOR PREPARING A THIXOTROPING AGENT AND USE THEREOF CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2012-01-05 WO disclosed
US-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF GALENEA CORPORATION 2011-06-16 US disclosed
CN-101889092-A Biofuel production BIO ARCHITECTURE LAB INC 2010-11-17 CN 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-20110144090-A1 COMPOUNDS AND METHODS OF USE THEREOF AANAT, HNMT, INMT RIPK1 2177/4885ACACB 433/4885ACACA 842/4885

“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.