SCHEMBL13560828

SCHEMBL13560828

CC(C)(C(=O)O)c1cccc(C(O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH1 P35367 6/20 0.81
▸ KCNH2 Q12809 4/20 0.81
▸ LMNA P02545 3/20 0.81
▸ DRD3 P35462 3/20 0.81
▸ HTR2A P28223 2/20 0.81
▸ HTR2B P41595 2/20 0.81
▸ BLM P54132 2/20 0.81
▸ CNR1 P21554 1/20 0.81
▸ APEX1 P27695 1/20 0.81
▸ PDE4A P27815 1/20 0.81
▸ PDE3A Q14432 1/20 0.81
▸ DRD2 P14416 2/20 0.80
▸ ALOX15 P16050 1/20 0.80
▸ HSD17B10 Q99714 1/20 0.80
▸ CYP2J2 P51589 4/20 0.68
▸ MEN1 O00255 1/20 0.68
▸ NPC1 O15118 1/20 0.68
▸ CACNA1F O60840 1/20 0.68
▸ GMNN O75496 1/20 0.68
▸ USP2 O75604 1/20 0.68

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
SCHEMBL16345651 1.00 HRH1 (0.81) HRH1KCNH2LMNADRD3HTR2A
Hydrochloric Acid SCHEMBL13516884 0.99 HRH1 (0.82) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL4900 0.90 HRH1 (1.00) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL7104316 0.90 HRH1 (1.00) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL1561082 0.90 HRH1 (1.00) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL4901 0.90 HRH1 (1.00) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL1972366 0.90 HRH1 (1.00) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL3178320 0.90 HRH1 (1.00) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL16652201 0.89 HRH1 (0.98) HRH1KCNH2LMNADRD3HTR2A
Fexofenadine SCHEMBL9943442 0.89 HRH1 (0.98) HRH1KCNH2LMNADRD3HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10130620-B2 Liquid pharmaceutical composition for oral administration comprising fexofenadine AVENTISUB LLC (US) 2018-11-20 — — US disclosed
US-20160184284-A1 LIQUID PHARMACEUTICAL COMPOSITION FOR ORAL ADMINISTRATION COMPRISING FEXOFENADINE CHATTEM, INC. 2016-06-30 — — US disclosed
EP-3016635-A1 LIQUID PHARMACEUTICAL COMPOSITION FOR ORAL ADMINISTRATION COMPRISING FEXOFENADINE Aventisub LLC (US) 2016-05-11 — — EP disclosed
WO-2015001478-A1 LIQUID PHARMACEUTICAL COMPOSITION FOR ORAL ADMINISTRATION COMPRISING FEXOFENADINE AVENTIS PHARMACEUTICALS INC. (US) 2015-01-08 — — WO disclosed
EP-2532644-A1 Preparation of 2-(4-bromophenyl)-2-methylpropanoic acid Divi's Laboratories Limited (IN) 2012-12-12 — — EP disclosed
US-20120309973-A1 PREPARATION OF 2-(4-BROMOPHENYL)-2-METHYLPROPANOIC ACID DIVI'S LABORATORIES LIMITED (IN) 2012-12-06 — — US disclosed
US-20120276199-A1 TASTE MASKED PHARMACEUTICAL FORMULATIONS DR. REDDY'S LABORATORIES LIMITED (IN) 2012-11-01 — — US disclosed
US-20120276199-A1 TASTE MASKED PHARMACEUTICAL FORMULATIONS DR. REDDY'S LABORATORIES LIMITED (IN) 2012-11-01 — — 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 (4 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-20120309973-A1 PREPARATION OF 2-(4-BROMOPHENYL)-2-METHYLPROPANOIC ACID HRH2, NPFFR2, GABRA6 HRH1 26/4885KCNH2 371/4885LMNA 4153/4885
US-20160184284-A1 LIQUID PHARMACEUTICAL COMPOSITION FOR ORAL ADMINISTRATION COMPRISING FEXOFENADINE SORD, SFXN1, SLC10A2 HRH1 88/4885KCNH2 1049/4885LMNA 4217/4885
US-10130620-B2 Liquid pharmaceutical composition for oral administration comprising fexofenadine SORD, SFXN1, SLC10A2 HRH1 88/4885KCNH2 1049/4885LMNA 4217/4885
US-20120276199-A1 TASTE MASKED PHARMACEUTICAL FORMULATIONS TAS2R5, TAS2R20, TAS1R2 HRH1 52/4885KCNH2 212/4885LMNA 4193/4885

“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.

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