SCHEMBL4136558

SCHEMBL4136558

CC(=O)CCC(O)CCCO

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.44
GPR84 Q9NQS5 4/20 0.41
FFAR4 Q5NUL3 1/20 0.39
FFAR1 O14842 1/20 0.39
ALDH1A1 P00352 1/20 0.39
NFKB1 P19838 1/20 0.38
ACACB O00763 1/20 0.35
ACACA Q13085 1/20 0.35
ACHE P22303 1/20 0.33
PAOX Q6QHF9 1/20 0.33
LMNA P02545 1/20 0.33
SLC15A2 Q16348 1/20 0.33
CAMK2A Q9UQM7 1/20 0.33
FAAH O00519 1/20 0.33

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
SCHEMBL31512910 0.91 GPR84 (0.43) PTPN1GPR84FFAR4FFAR1ALDH1A1
SCHEMBL19628780 0.83 FFAR4 (0.50) PTPN1GPR84FFAR4FFAR1NFKB1
SCHEMBL19628779 0.83 FFAR4 (0.50) PTPN1GPR84FFAR4FFAR1NFKB1
SCHEMBL19628781 0.83 FFAR4 (0.50) PTPN1GPR84FFAR4FFAR1NFKB1
SCHEMBL19628773 0.83 FFAR4 (0.50) PTPN1GPR84FFAR4FFAR1NFKB1
SCHEMBL10598029 0.82 GPR84 (0.55) GPR84FFAR4FFAR1NFKB1ACHE
SCHEMBL11781608 0.82 GPR84 (0.41) PTPN1GPR84FFAR4FFAR1ALDH1A1
SCHEMBL27840946 0.80 FFAR4 (0.47) PTPN1GPR84FFAR4FFAR1ALDH1A1
SCHEMBL3337297 0.79 PTPN1 (0.55) PTPN1GPR84FFAR4FFAR1NFKB1
SCHEMBL27757278 0.79 GPR84 (0.42) PTPN1GPR84FFAR4FFAR1ALDH1A1

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
US-11008593-B2 Process for producing 1,3-propanediol compound Photanol, B.V. 2021-05-18 US disclosed
US-20190345523-A1 PROCESS OF PRODUCING AN ORGANIC COMPOUND AND AN INTERMEDIARY COMPOUND UNIVERSITEIT VAN AMSTERDAM (NL) 2019-11-14 US disclosed
US-20190177752-A1 Process for Producing an Organic Compound PHOTANOL BV. (NL) 2019-06-13 US disclosed
US-10131924-B2 Process for producing an organic compound and an intermediary compound PHOTANOL B.V. (NL) 2018-11-20 US disclosed
US-20160083756-A1 PROCESS FOR PRODUCING AN ORGANIC COMPOUND RENOLIT HEALTHCARE B.V. (NL) 2016-03-24 US disclosed
US-9228210-B2 Process for producing an organic compound PHOTANOL B.V. (NL) 2016-01-05 US disclosed
WO-2014092562-A1 SYNTHESIS OF ACETOIN, 2,3-BUTANEDIOL AND 2-BUTANOL BY CYANOBACTERIA BY HETEROLOGOUS EXPRESSION OF A CATABOLIC PATHWAY PHOTANOL B.V. (NL) 2014-06-19 WO disclosed
US-20090221596-A1 Substtituted aryl oximes BAYER CROPSCIENCE AG (DE) 2009-09-03 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-20090221596-A1 Substtituted aryl oximes CYP1A1, PRDX1, CYP1A2 PTPN1 566/4885GPR84 2660/4885FFAR4 4192/4885

“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.