SCHEMBL18090280

SCHEMBL18090280

C#CCCC(=O)NCCCOCC(COCCC(=O)NCCNC(=O)CCN1C(=O)C=CC1=O)(COCCC(=O)NCCNC(=O)CCN1C(=O)C=CC1=O)COCCC(=O)NCCNC(=O)CCN1C(=O)C=CC1=O

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C19 P33261 1/20 0.31
MGLL Q99685 1/20 0.31
PTGS1 P23219 4/20 0.30
PTGS2 P35354 4/20 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
SCHEMBL18090270 0.91 MGLL (0.33) POLBHSD17B10TSHRMGLLPTGS1
SCHEMBL18090271 0.91 MGLL (0.33) POLBHSD17B10TSHRMGLLPTGS1
SCHEMBL18090266 0.91 MGLL (0.33) POLBHSD17B10TSHRMGLLPTGS1
SCHEMBL18090277 0.86 MGLL (0.34) POLBHSD17B10TSHRSMN1; SMN2CYP2C19
SCHEMBL18090275 0.86 MGLL (0.34) POLBHSD17B10TSHRSMN1; SMN2CYP2C19
SCHEMBL18090281 0.86 MGLL (0.34) POLBHSD17B10TSHRSMN1; SMN2CYP2C19
SCHEMBL18090273 0.82 POLB (0.31) POLBHSD17B10TSHR
SCHEMBL19575061 0.81 MGLL (0.44) POLBHSD17B10TSHRSMN1; SMN2CYP2C19
SCHEMBL18085735 0.79 TSHR (0.35) POLBHSD17B10TSHRSMN1; SMN2CYP3A4
SCHEMBL18085749 0.79 TSHR (0.35) POLBHSD17B10TSHRSMN1; SMN2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160271267-A1 ALKYNYL MULTI-ARM POLYETHYLENE GLYCOL DERIVATIVE JENKEM TECHNOLOGY CO., LTD. (BEIJING) (CN) 2016-09-22 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-20160271267-A1 ALKYNYL MULTI-ARM POLYETHYLENE GLYCOL DERIVATIVE F12, IGLV6-57, F11 POLB 1448/4885HSD17B10 419/4885TSHR 3100/4885

“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.