SCHEMBL23626600

SCHEMBL23626600

C=CCC(=O)c1ccc2oc3ccccc3c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
BCAT1 P54687 6/20 0.47
LMNA P02545 2/20 0.47
KDM4E B2RXH2 3/20 0.44
MAPT P10636 3/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTR2B P41595 1/20 0.43
GAA P10253 1/20 0.41
GLA P06280 1/20 0.41
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL3557297 0.84 TTR (0.53) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL10992173 0.81 TTR (0.55) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL30765908 0.80 TTR (0.54) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL3875921 0.80 TTR (0.54) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL16581127 0.80 TTR (0.54) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL11352725 0.80 TTR (0.54) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL19996340 0.77 TTR (0.46) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL1222307 0.77 TTR (0.78) TTRNPC1RAB9ABCAT1LMNA
SCHEMBL11599094 0.77 NPC1 (0.57) TTRNPC1RAB9ABCAT1LMNA
Furobufen SCHEMBL30901203 0.77 CYP1A2 (0.58) TTRNPC1RAB9ABCAT1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220165963-A1 ORGANIC COMPOUND, USE THEREOF AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-05-26 US disclosed
WO-2021136034-A1 ORGANIC COMPOUND, USE THEREOF AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 陕西莱特光电材料股份有限公司 2021-07-08 WO 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-20220165963-A1 ORGANIC COMPOUND, USE THEREOF AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME ARL1, ORC3, EML4 TTR 3028/4885NPC1 1894/4885RAB9A 1281/4885

“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.