SCHEMBL8139996

SCHEMBL8139996

Cc1cccc(CNC2=NCCN2)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR1D P28221 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ NLRP3 Q96P20 1/20 0.50
▸ LMNA P02545 4/20 0.49
▸ GAA P10253 1/20 0.49
▸ APOBEC3A P31941 1/20 0.49
▸ CTDSP1 Q9GZU7 1/20 0.49
▸ APOBEC3G Q9HC16 1/20 0.49
▸ ADRA2A P08913 5/20 0.48
▸ ADRA2B P18089 4/20 0.48
▸ ADRA2C P18825 4/20 0.48
▸ ADRA1D P25100 3/20 0.48
▸ ADRA1A P35348 3/20 0.48
▸ ADRA1B P35368 3/20 0.48
▸ WDR5 P61964 7/20 0.47
▸ PTGIR P43119 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ SLC22A1 O15245 1/20 0.46
▸ SLC22A3 O75751 1/20 0.46
▸ HTR1A P08908 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
SCHEMBL560655 0.86 ADRA2A (0.55) SMN1; SMN2NLRP3LMNAGAAAPOBEC3A
SCHEMBL561022 0.86 HTR1D (0.55) HTR1DSMN1; SMN2NLRP3LMNAGAA
SCHEMBL560664 0.85 LMNA (0.56) HTR1DSMN1; SMN2NLRP3LMNAGAA
SCHEMBL561403 0.83 LMNA (0.62) SMN1; SMN2NLRP3LMNAGAAAPOBEC3A
SCHEMBL20017860 0.83 SMN1; SMN2 (0.50) HTR1DSMN1; SMN2NLRP3LMNAGAA
SCHEMBL8133645 0.83 SMN1; SMN2 (0.50) SMN1; SMN2NLRP3LMNAGAAAPOBEC3A
SCHEMBL8148008 0.83 LMNA (0.52) HTR1DSMN1; SMN2NLRP3LMNAGAA
SCHEMBL560777 0.80 LMNA (0.56) SMN1; SMN2NLRP3LMNAGAAAPOBEC3A
Iodide SCHEMBL16227866 0.78 LMNA (0.59) SMN1; SMN2NLRP3LMNAGAAAPOBEC3A
SCHEMBL8133648 0.78 ADRA2A (0.52) SMN1; SMN2NLRP3LMNAGAAAPOBEC3A

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230062049-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. 2023-03-02 — — US disclosed
US-20200330428-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN INC (US) 2020-10-22 — — US disclosed
EP-2303264-B1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS USING IMIDAZOLINE DERIVATIVES ALLERGAN INC (US) 2018-04-04 — — EP disclosed
US-20180071260-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. 2018-03-15 — — US disclosed
US-20180071260-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. 2018-03-15 — — US disclosed
US-9849113-B2 Methods of treating α adrenergic mediated conditions ALLERGAN, INC. (US) 2017-12-26 — — US disclosed
US-9849113-B2 Methods of treating α adrenergic mediated conditions ALLERGAN, INC. (US) 2017-12-26 — — US disclosed
US-20170172982-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. 2017-06-22 — — US disclosed
US-20170172982-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. 2017-06-22 — — US disclosed
US-9623006-B2 Methods of treating α adrenergic mediated conditions ALLERGAN, INC. (US) 2017-04-18 — — US disclosed
US-8071636-B2 Methods of treating alpha adrenergic mediated conditions ALLERGAN, INC. (US) 2011-12-06 — — US disclosed
US-8071636-B2 Methods of treating alpha adrenergic mediated conditions ALLERGAN, INC. (US) 2011-12-06 — — US disclosed
US-8063231-B2 Methods of treating alpha adrenergic mediated conditions ALLERGAN, INC. (US) 2011-11-22 — — US disclosed
US-8063231-B2 Methods of treating alpha adrenergic mediated conditions ALLERGAN, INC. (US) 2011-11-22 — — US disclosed
WO-2009152053-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS USING IMIDAZOLINE DERIVATES ALLERGAN, INC. (US) 2009-12-17 — — WO disclosed
WO-2009152052-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. (US) 2009-12-17 — — WO disclosed
US-20090306398-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. (US) 2009-12-10 — — US disclosed
US-20090306161-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. (US) 2009-12-10 — — US disclosed
US-20090306161-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. (US) 2009-12-10 — — US disclosed
US-20090306398-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ALLERGAN, INC. (US) 2009-12-10 — — 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 (6 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-20090306161-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ADRB2, ADRA2C, ADRA2A HTR1D 222/4885SMN1; SMN2 1109/4885NLRP3 3311/4885
US-20230062049-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ADRB2, ADRA2A, ADRA2C HTR1D 230/4885SMN1; SMN2 508/4885NLRP3 3439/4885
US-20090306398-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ADRB2, ADRA2C, ADRA2A HTR1D 222/4885SMN1; SMN2 1109/4885NLRP3 3311/4885
US-20170172982-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ADRB2, ADRA2A, ADRA2C HTR1D 230/4885SMN1; SMN2 508/4885NLRP3 3439/4885
US-20180071260-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ADRB2, ADRA2A, ADRA2C HTR1D 230/4885SMN1; SMN2 508/4885NLRP3 3439/4885
US-20200330428-A1 METHODS OF TREATING ALPHA ADRENERGIC MEDIATED CONDITIONS ADRB2, ADRA2A, ADRA2C HTR1D 230/4885SMN1; SMN2 508/4885NLRP3 3439/4885

“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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