SCHEMBL9151394

SCHEMBL9151394

CCCCCC(CC)OCCCNCCCOC(CC)CCCCC

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TSHR P16473 3/20 0.44
DNM1 Q05193 1/20 0.41
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
TLR2 O60603 2/20 0.33
ADH1B P00325 2/20 0.33
ADH1C P00326 2/20 0.33
ADH1A P07327 2/20 0.33
ADH4 P08319 2/20 0.33
ADH7 P40394 2/20 0.33
EPHX1 P07099 1/20 0.33
LPAR1 Q92633 4/20 0.33
LPAR3 Q9UBY5 4/20 0.33
CTSK P43235 1/20 0.33
LPAR2 Q9HBW0 1/20 0.33
CYP3A4 P08684 1/20 0.32

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
SCHEMBL9151681 0.98 DNM1 (0.44) ALDH1A1TSHRDNM1TLR2ADH1B
SCHEMBL9155643 0.98 DNM1 (0.44) ALDH1A1TSHRDNM1TLR2ADH1B
SCHEMBL4315814 0.92 DNM1 (0.43) ALDH1A1TSHRDNM1TLR2CYP3A4
SCHEMBL9152323 0.88 TSHR (0.37) ALDH1A1TSHRDNM1CTSKCYP3A4
SCHEMBL8663554 0.86 DNM1 (0.54) ALDH1A1DNM1CNR1CNR2TLR2
SCHEMBL28429637 0.86 DNM1 (0.48) ALDH1A1DNM1CNR1CNR2TLR2
SCHEMBL9807754 0.84 DNM1 (0.40) ALDH1A1TSHRDNM1TLR2CYP3A4
SCHEMBL23017083 0.84 DNM1 (0.57) ALDH1A1DNM1CNR1CNR2TLR2
SCHEMBL13292250 0.84 DNM1 (0.57) ALDH1A1DNM1CNR1CNR2TLR2
SCHEMBL25258976 0.84 DNM1 (0.57) ALDH1A1DNM1CNR1CNR2TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3927795-B1 MULTIFUNCTIONAL ADDITIVE COMPOUNDS HUNTSMAN PETROCHEMICAL LLC (US) 2024-05-22 EP disclosed
US-20220025262-A1 MULTIFUNCTIONAL ADDITIVE COMPOUNDS HUNTSMAN PETROCHEMICAL LLC 2022-01-27 US disclosed
CN-113454191-A Multifunctional additive compound 亨斯迈石油化学有限责任公司 2021-09-28 CN disclosed
US-5449386-A Fuel additives, antisedimentation agents INSTITUT FRANCAIS DU PETROLE (FR) 1995-09-12 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-20220025262-A1 MULTIFUNCTIONAL ADDITIVE COMPOUNDS MAOA, MAOB, AS3MT ALDH1A1 233/4885TSHR 4806/4885DNM1 2087/4885

“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.