SCHEMBL1233176

SCHEMBL1233176

Sc1n[nH]c(-c2cccnc2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.58
BTK Q06187 1/20 0.53
F2 P00734 1/20 0.49
F12 P00748 1/20 0.49
CYP3A4 P08684 4/20 0.48
CYP1A2 P05177 3/20 0.48
ALDH1A1 P00352 3/20 0.48
CYP2A6 P11509 3/20 0.48
ALPL P05186 1/20 0.47
KDM4E B2RXH2 2/20 0.46
LDHA P00338 1/20 0.46
EPHX2 P34913 1/20 0.46
ALPI P09923 1/20 0.45
ALPG P10696 1/20 0.45
HTT P42858 1/20 0.45
CYP2E1 P05181 2/20 0.44
CYP2B6 P20813 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 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
SCHEMBL11598851 0.80 SMN1; SMN2 (0.87) SMN1; SMN2BTKF2F12CYP3A4
SCHEMBL688527 0.79 NR1H2 (0.61) SMN1; SMN2BTKF2F12CYP1A2
SCHEMBL5787498 0.79 ALDH1A1 (0.65) SMN1; SMN2BTKF2F12CYP3A4
SCHEMBL2629350 0.79 SMN1; SMN2 (0.58) SMN1; SMN2BTKF2F12CYP3A4
SCHEMBL2251043 0.77 SMN1; SMN2 (0.87) SMN1; SMN2BTKF2F12CYP3A4
SCHEMBL1032584 0.77 ROCK2 (0.45) SMN1; SMN2F2F12KDM4EMAPT
SCHEMBL17280142 0.76 SMN1; SMN2 (0.73) SMN1; SMN2BTKF2F12ALDH1A1
SCHEMBL15452340 0.76 SMN1; SMN2 (0.73) SMN1; SMN2BTKF2F12KDM4E
SCHEMBL4103153 0.75 SMN1; SMN2 (0.54) SMN1; SMN2BTKF2F12CYP3A4
SCHEMBL8400430 0.75 DCUN1D1 (0.68) SMN1; SMN2BTKCYP3A4CYP1A2ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2703062-B1 METHOD FOR ABSORBING ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT BY MEANS OF AN AMINE-BASED AQUEOUS SOLUTION IFP ENERGIES NOW (FR) 2022-10-12 EP claimed
US-10137404-B2 Method of absorbing acid compounds contained in a gaseous effluent using an amine-based aqueous solution IFP Energies Nouvelles (FR) 2018-11-27 US claimed
US-9139512-B2 Absorbent solution containing a degradation inhibitor derived from a triazole or from a tetrazole and method of absorbing acid compounds contained in a gaseous effluent IFP Energies Nouvelles (FR) 2015-09-22 US claimed
US-20140060328-A1 METHOD OF ABSORBING ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT USING AN AMINE-BASED AQUEOUS SOLUTION IFP Energies Nouvelles (FR) 2014-03-06 US claimed
EP-2703062-A2 Method for absorbing acid compounds contained in a gaseous effluent by means of an amine-based aqueous solution IFP Energies nouvelles (FR) 2014-03-05 EP claimed
EP-2459518-B1 ABSORBENT SOLUTION CONTAINING A DEGRADATION INHIBITOR DERIVED FROM A TRIAZOLE OR FROM A TETRAZOLE AND PROCESS FOR THE ABSORPTION OF ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT IFP Energies Nouvelles (FR) 2013-12-11 EP claimed
US-20120148463-A1 ABSORBENT SOLUTION CONTAINING A DEGRADATION INHIBITOR DERIVED FROM A TRIAZOLE OR FROM A TETRAZOLE AND METHOD OF ABSORBING ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT IFP Energies Nouvelles (FR) 2012-06-14 US claimed
EP-2459518-A1 ABSORBENT SOLUTION CONTAINING A DEGRADATION INHIBITOR DERIVED FROM A TRIAZOLE OR FROM A TETRAZOLE AND PROCESS FOR THE ABSORPTION OF ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT IFP Energies nouvelles (FR) 2012-06-06 EP claimed
WO-2011012777-A1 ABSORBENT SOLUTION CONTAINING A DEGRADATION INHIBITOR DERIVED FROM A TRIAZOLE OR FROM A TETRAZOLE AND PROCESS FOR THE ABSORPTION OF ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT IFP Energies Nouvelles (FR) 2011-02-03 WO claimed
EP-2703062-B1 METHOD FOR ABSORBING ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT BY MEANS OF AN AMINE-BASED AQUEOUS SOLUTION IFP ENERGIES NOW (FR) 2022-10-12 EP disclosed
US-10137404-B2 Method of absorbing acid compounds contained in a gaseous effluent using an amine-based aqueous solution IFP Energies Nouvelles (FR) 2018-11-27 US disclosed
US-9139512-B2 Absorbent solution containing a degradation inhibitor derived from a triazole or from a tetrazole and method of absorbing acid compounds contained in a gaseous effluent IFP Energies Nouvelles (FR) 2015-09-22 US disclosed
US-20140060328-A1 METHOD OF ABSORBING ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT USING AN AMINE-BASED AQUEOUS SOLUTION IFP Energies Nouvelles (FR) 2014-03-06 US disclosed
EP-2703062-A2 Method for absorbing acid compounds contained in a gaseous effluent by means of an amine-based aqueous solution IFP Energies nouvelles (FR) 2014-03-05 EP disclosed
WO-2011012777-A1 ABSORBENT SOLUTION CONTAINING A DEGRADATION INHIBITOR DERIVED FROM A TRIAZOLE OR FROM A TETRAZOLE AND PROCESS FOR THE ABSORPTION OF ACID COMPOUNDS CONTAINED IN A GASEOUS EFFLUENT IFP Energies Nouvelles (FR) 2011-02-03 WO disclosed
US-RE36374-E 1,2,3-triazole and tetrazole substituted piperidine or tetrahydropyridine compounds useful as acetylcholine agonists H. LUNDBECK, A/S (DK) 1999-11-02 US disclosed
EP-0296721-B1 HETEROCYCLIC COMPOUNDS H. LUNDBECK A/S (DK) 1993-06-23 EP disclosed
US-4925858-A NERVOUS SYSTEM DISORDERS, ALZHEIMER*S DISEASE H. LUNDBECK A/S (DK) 1990-05-15 US disclosed
US-4866077-A TREATMENT OF NERVOUS SYSTEM DISORDERS SUCH AS ALZHEIMER*S DISEASE H. LUNDBECK A/S (DK) 1989-09-12 US disclosed
EP-0296721-A2 Heterocyclic compounds H. LUNDBECK A/S (DK) 1988-12-28 EP disclosed