SCHEMBL20536669

SCHEMBL20536669

CCCCC/C=C\C/C=C\CCCCCC(OCC)OCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
CNR1 P21554 1/20 0.50
CNR2 P34972 1/20 0.50
TRPV1 Q8NER1 1/20 0.47
F7 P08709 2/20 0.46
F3 P13726 2/20 0.46
DUSP3 P51452 1/20 0.46
PTPN7 P35236 1/20 0.46
KDM4E B2RXH2 1/20 0.46
FFAR1 O14842 1/20 0.46
LMNA P02545 1/20 0.46
FABP3 P05413 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP19A1 P11511 1/20 0.46
FABP4 P15090 1/20 0.46
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
PTGS1 P23219 1/20 0.46
GNA15 P30679 1/20 0.46

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
SCHEMBL20912483 1.00 ALDH1A1 (0.50) ALDH1A1CNR1CNR2TRPV1F7
SCHEMBL20912484 1.00 ALDH1A1 (0.50) ALDH1A1CNR1CNR2TRPV1F7
SCHEMBL34463873 0.94 FAAH (0.47) ALDH1A1CNR1CNR2TRPV1DUSP3
SCHEMBL10390187 0.91 FAAH (0.42) ALDH1A1CNR1CNR2TRPV1F7
SCHEMBL10390188 0.91 FAAH (0.42) ALDH1A1CNR1CNR2TRPV1F7
SCHEMBL6436391 0.91 FAAH (0.47) ALDH1A1CNR1CNR2TRPV1DUSP3
SCHEMBL6436392 0.91 FAAH (0.47) ALDH1A1CNR1CNR2TRPV1DUSP3
SCHEMBL26650545 0.89 FAAH (0.41) ALDH1A1CNR1CNR2TRPV1F7
SCHEMBL20536247 0.88 ALDH1A1 (0.53) ALDH1A1CNR1CNR2TRPV1
SCHEMBL7753870 0.87 ALDH1A1 (0.46) ALDH1A1CNR1CNR2F7F3

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-108727170-B 1-halo-6, 9-pentadecadienes and process for preparing (7Z,10Z) -7, 10-hexadecadienals 信越化学工业株式会社 2021-10-26 CN disclosed
EP-3392231-B1 1-HALO-6,9-PENTADECADIENE AND METHOD FOR PRODUCING (7Z,10Z)-7,10-HEXADECADIENAL SHINETSU CHEMICAL CO (JP) 2019-04-24 EP disclosed
US-10138191-B2 1-halo-6,9-pentadecadiene and method for producing (7Z,10Z)-7,10-hexadecadienal SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-11-27 US disclosed
US-20180305284-A1 1-HALO-6,9-PENTADECADIENE AND METHOD FOR PRODUCING (7Z,10Z)-7,10-HEXADECADIENAL SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-10-25 US disclosed
EP-3392231-A1 1-HALO-6,9-PENTADECADIENE AND METHOD FOR PRODUCING (7Z,10Z)-7,10-HEXADECADIENAL Shin-Etsu Chemical Co., Ltd. (JP) 2018-10-24 EP 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-20180305284-A1 1-HALO-6,9-PENTADECADIENE AND METHOD FOR PRODUCING (7Z,10Z)-7,10-HEXADECADIENAL HDHD5, OSR1, CYP8B1 ALDH1A1 1017/4885CNR1 3038/4885CNR2 3914/4885
US-10138191-B2 1-halo-6,9-pentadecadiene and method for producing (7Z,10Z)-7,10-hexadecadienal HDHD5, OSR1, CYP8B1 ALDH1A1 1017/4885CNR1 3038/4885CNR2 3914/4885

“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.