SCHEMBL4844384

SCHEMBL4844384

COC(=O)CCCOc1ccc(CCN)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.51
TAAR1 Q96RJ0 1/20 0.50
LMNA P02545 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
FFAR1 O14842 2/20 0.47
MAOB P27338 1/20 0.46

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
Hydrochloric Acid SCHEMBL25295887 0.91 LTA4H (0.45) LTA4HTAAR1LMNAFFAR1
Hydrochloric Acid SCHEMBL25260760 0.88 LTA4H (0.45) LTA4HTAAR1LMNAFFAR1
SCHEMBL4838190 0.88 LTA4H (0.53) LTA4HLMNAMAOB
Hydrochloric Acid SCHEMBL25376075 0.86 LTA4H (0.52) LTA4HLMNAMAOB
SCHEMBL27545059 0.86 ADRB2 (0.54) LTA4HLMNAL3MBTL1ADRB2ADRB1
SCHEMBL14162906 0.86 ALDH1A1 (0.60) LTA4HLMNAL3MBTL1ADRB2ADRB1
Hydrochloric Acid SCHEMBL25298359 0.85 ITGB3 (0.43) LTA4HTAAR1LMNAFFAR1MAOB
SCHEMBL188550 0.84 MAPT (0.50) LTA4HLMNAL3MBTL1
Hydrochloric Acid SCHEMBL10869249 0.84 TAAR1 (0.47) TAAR1LMNAMAOB
SCHEMBL28588481 0.83 LMNA (0.56) LTA4HLMNAL3MBTL1FFAR1

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
CN-111205291-B Triazolo ring compound, preparation method, intermediate and application thereof 上海科技大学 2022-08-23 CN disclosed
CN-111205291-A Triazolo ring compound, preparation method, intermediate and application thereof 上海科技大学 2020-05-29 CN disclosed
US-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 LTA4H 1742/4885TAAR1 509/4885LMNA 1943/4885

“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.