SCHEMBL1016222

SCHEMBL1016222

C/C=C/CCCCCO[CH]CC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR2 Q9HBW0 6/20 0.38
LPAR3 Q9UBY5 6/20 0.38
LPAR1 Q92633 3/20 0.38
ALDH1A1 P00352 3/20 0.32
CYP3A4 P08684 2/20 0.32
ALOX15 P16050 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
TSHR P16473 1/20 0.32
F7 P08709 2/20 0.32
F3 P13726 2/20 0.32
MAPT P10636 2/20 0.32
OXER1 Q8TDS5 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
FFAR1 O14842 1/20 0.32
NR1I2 O75469 1/20 0.32
LMNA P02545 1/20 0.32
PLA2G1B P04054 1/20 0.32
CYP19A1 P11511 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
SCHEMBL3630099 1.00 LPAR2 (0.38) LPAR2LPAR3LPAR1ALDH1A1CYP3A4
SCHEMBL1016020 0.98 LPAR2 (0.35) LPAR2LPAR3LPAR1ALDH1A1
SCHEMBL3635450 0.91 NR1I2 (0.32) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL1015433 0.91 NR1I2 (0.32) ALDH1A1CYP3A4ALOX15HSD17B10TDP1
SCHEMBL1096251 0.83 LPAR2 (0.50) LPAR2LPAR3LPAR1
SCHEMBL1016618 0.82
SCHEMBL1017534 0.80 LPAR2 (0.33) LPAR2LPAR3LPAR1
SCHEMBL1015874 0.78 LPAR2 (0.31) LPAR2LPAR3LPAR1
SCHEMBL1016560 0.77 TSHR (0.50) LPAR2LPAR3LPAR1ALDH1A1CYP3A4
SCHEMBL1017576 0.77 TSHR (0.50) LPAR2LPAR3LPAR1ALDH1A1CYP3A4

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-8247595-B2 Organic sulfur compound and its use for controlling harmful arthropod SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
EP-2152668-B1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPODS SUMITOMO CHEMICAL CO (JP) 2011-01-12 EP disclosed
US-20100160434-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-24 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-20100160434-A1 ORGANIC SULFUR COMPOUND AND ITS USE FOR CONTROLLING HARMFUL ARTHROPOD C5, L3MBTL3, C1S LPAR2 4014/4885LPAR3 2323/4885LPAR1 3086/4885

“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.