SCHEMBL4938792

SCHEMBL4938792

[B].c1ccc2nc(Cc3ccc4ccccc4n3)ccc2c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 2/20 0.55
CYSLTR2 Q9NS75 1/20 0.55
LMNA P02545 1/20 0.51
CYP1A2 P05177 2/20 0.50
NCF1 P14598 2/20 0.50
NOS2 P35228 1/20 0.48
BACE1 P56817 1/20 0.48
CA12 O43570 1/20 0.48
CA9 Q16790 1/20 0.48
PDE10A Q9Y233 3/20 0.46
ALDH1A1 P00352 1/20 0.44
GLA P06280 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
ACHE P22303 1/20 0.44
GPBAR1 Q8TDU6 1/20 0.44

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
SCHEMBL3267444 0.98 CYSLTR1 (0.57) CYSLTR1CYSLTR2LMNACYP1A2NCF1
SCHEMBL30879956 0.98 CYSLTR1 (0.57) CYSLTR1CYSLTR2LMNACYP1A2NCF1
SCHEMBL26911035 0.87 CYSLTR1 (0.53) CYSLTR1CYSLTR2LMNACYP1A2NCF1
SCHEMBL3253637 0.85 CYSLTR1 (0.55) CYSLTR1CYSLTR2LMNACYP1A2NCF1
SCHEMBL1568267 0.84 SMN1; SMN2 (0.57) CYSLTR1CYSLTR2LMNACYP1A2PDE10A
SCHEMBL2913941 0.83 PDE10A (0.61) CYSLTR1CYSLTR2CYP1A2NCF1NOS2
Hydrochloric Acid SCHEMBL27514003 0.83 CYSLTR1 (0.53) CYSLTR1CYSLTR2LMNACYP1A2NCF1
SCHEMBL29035750 0.83 CYSLTR1 (0.53) CYSLTR1CYSLTR2LMNACYP1A2NCF1
SCHEMBL21499258 0.82 CYP1A2 (0.50) CYSLTR1CYSLTR2LMNACYP1A2NCF1
SCHEMBL7972071 0.82 CYSLTR1 (0.45) CYSLTR1CYSLTR2LMNACYP1A2NCF1

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-7329466-B2 Organic element for electroluminescent devices EASTMAN KODAK COMPANY (US) 2008-02-12 US disclosed
US-20060210829-A9 Organic element for electroluminescent devices EASTMAN KODAK COMPANY 2006-09-21 US disclosed
WO-2005076385-A1 A BIS(AZINYL) METHENE BORON COMPLEX USED AS AN EMISSIVE DOPANT IN AN ORGANIC LIGHT EMITTING DEVICE EASTMAN KODAK COMPANY (US) 2005-08-18 WO disclosed
US-20050170204-A1 Organic element for electroluminescent devices EASTMAN KODAK COMPANY 2005-08-04 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 (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-20060210829-A9 Organic element for electroluminescent devices EED, JUND, OCIAD2 CYSLTR1 2530/4885CYSLTR2 1318/4885LMNA 1419/4885
US-20050170204-A1 Organic element for electroluminescent devices EED, JUND, OCIAD2 CYSLTR1 2530/4885CYSLTR2 1318/4885LMNA 1419/4885

“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.