SCHEMBL3271769

SCHEMBL3271769

CCCCCCCC(Br)C=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48
ADH1B P00325 2/20 0.47
ADH1C P00326 2/20 0.47
ADH1A P07327 2/20 0.47
ADH4 P08319 2/20 0.47
ADH7 P40394 2/20 0.47
ZDHHC7 Q9NXF8 1/20 0.44
TSHR P16473 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 2/20 0.41
TRPA1 O75762 1/20 0.41
DDAH1 O94760 1/20 0.41
GAPDH P04406 1/20 0.41
GPR84 Q9NQS5 3/20 0.40
FDPS P14324 3/20 0.40
SPHK1 Q9NYA1 1/20 0.40
FFAR1 O14842 1/20 0.40

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
SCHEMBL3277201 1.00 LCK (0.48) LCKPPARDZDHHC20ZDHHC2ADH1B
SCHEMBL8985585 1.00 LCK (0.48) LCKPPARDZDHHC20ZDHHC2ADH1B
SCHEMBL8985634 1.00 LCK (0.48) LCKPPARDZDHHC20ZDHHC2ADH1B
SCHEMBL1314019 1.00 LCK (0.48) LCKPPARDZDHHC20ZDHHC2ADH1B
SCHEMBL738319 1.00 LCK (0.48) LCKPPARDZDHHC20ZDHHC2ADH1B
SCHEMBL3266925 0.98
SCHEMBL4725182 0.90
SCHEMBL28813034 0.88
SCHEMBL28988982 0.88
SCHEMBL922060 0.79

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
US-7692021-B2 NPN-type low molecular aromatic ring compounds and organic semiconductors and electronic devices incorporating such compounds SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-04-06 US disclosed
US-7692021-B2 NPN-type low molecular aromatic ring compounds and organic semiconductors and electronic devices incorporating such compounds SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-04-06 US disclosed
US-20070166871-A1 NPN-type low molecular aromatic ring compounds and organic semiconductors and electronic devices incorporating such compounds SAMSUNG ELECTRONICS CO., LTD. 2007-07-19 US disclosed
US-20070166871-A1 NPN-type low molecular aromatic ring compounds and organic semiconductors and electronic devices incorporating such compounds SAMSUNG ELECTRONICS CO., LTD. 2007-07-19 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-20070166871-A1 NPN-type low molecular aromatic ring compounds and organic semiconductors and electronic devices incorporating such compounds PNN, PNP, TYR LCK 632/4885PPARD 2771/4885ZDHHC20 2580/4885

“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.