Sb-773812

Sb-773812

SCHEMBL4510120

COc1cc2c(cc1S(=O)(=O)c1ccc(OCc3ccc(Cl)cc3)cc1)CCN(C)CC2.O=C(O)C=CC(=O)O

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DRD2HTR2A

The experimentally established mechanism targets of Sb-773812. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 known ✓ P14416 1/20 0.44
HTR2A known ✓ P28223 1/20 0.44
REV1 Q9UBZ9 1/20 0.45
HTR2C P28335 1/20 0.44
DRD3 P35462 1/20 0.44
HTR6 P50406 1/20 0.44
HRH3 Q9Y5N1 5/20 0.43
CHRNA7 P36544 2/20 0.42
PKM P14618 2/20 0.41
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 1/20 0.39
MMP1 P03956 1/20 0.39
MMP9 P14780 1/20 0.39
MMP13 P45452 1/20 0.39
ADAM17 P78536 1/20 0.39
ABCB1 P08183 1/20 0.39
GRIN2C Q14957 1/20 0.39

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
Sb-773812 SCHEMBL5471358 1.00 REV1 (0.45) REV1DRD2HTR2AHTR2CDRD3
Sb-773812 SCHEMBL4510111 1.00 REV1 (0.45) REV1DRD2HTR2AHTR2CDRD3
SCHEMBL4889865 0.93 DRD2 (0.50) REV1DRD2HTR2AHTR2CDRD3
Sb-773812 SCHEMBL3896727 0.93 DRD2 (0.50) REV1DRD2HTR2AHTR2CDRD3
Sb-773812 SCHEMBL29377490 0.93 DRD2 (0.50) REV1DRD2HTR2AHTR2CDRD3
Hydrochloric Acid SCHEMBL3897702 0.92 DRD2 (0.49) REV1DRD2HTR2AHTR2CDRD3
Sb-773812 SCHEMBL3893974 0.92 DRD2 (0.49) REV1DRD2HTR2AHTR2CDRD3
Sb-773812 SCHEMBL5456117 0.88 MMP1 (0.45) REV1DRD2HTR2AHTR2CDRD3
SCHEMBL3897281 0.84 HRH3 (0.46) REV1DRD2HTR2AHTR2CDRD3
SCHEMBL4510117 0.84 GRIN2C (0.42) DRD2HTR2AHTR2CDRD3HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163475-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2009-06-25 US claimed
EP-1885699-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2008-02-13 EP claimed
US-20070275948-A1 7-[4-(4-Chlorobenzyloxy)Benzenesulfonyl]-8-Methoxy-3-Methyl-2,3,4,5-Tetrahydro-1h-3-Benzazepinium Maleate Or Tosylate As antipyschotics GLAXO GROUP LIMITED (GB) 2007-11-29 US claimed
WO-2006125622-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2006-11-30 WO claimed
US-20090163475-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2009-06-25 US disclosed
US-20090163475-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2009-06-25 US disclosed
CN-101184735-A Crystalline form of benzazepinium maleate derivative GLAXO GROUP LTD (GB) 2008-05-21 CN disclosed
EP-1885699-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2008-02-13 EP disclosed
EP-1885699-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2008-02-13 EP disclosed
US-20070275948-A1 7-[4-(4-Chlorobenzyloxy)Benzenesulfonyl]-8-Methoxy-3-Methyl-2,3,4,5-Tetrahydro-1h-3-Benzazepinium Maleate Or Tosylate As antipyschotics GLAXO GROUP LIMITED (GB) 2007-11-29 US disclosed
US-20070275948-A1 7-[4-(4-Chlorobenzyloxy)Benzenesulfonyl]-8-Methoxy-3-Methyl-2,3,4,5-Tetrahydro-1h-3-Benzazepinium Maleate Or Tosylate As antipyschotics GLAXO GROUP LIMITED (GB) 2007-11-29 US disclosed
US-20070225276-A1 7-Phenylsulfonyl-Tetrahydro-3-Benzazepine Dervatives as Antipsychotic Agents GLAXO GROUP LIMITED (GB) 2007-09-27 US disclosed
WO-2006125622-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2006-11-30 WO disclosed
WO-2006125622-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE GLAXO GROUP LIMITED (GB) 2006-11-30 WO disclosed
EP-1687005-A1 7-PHENYLSULFONYL-TETRAHYDRO-3-BENZAZEPINE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2006-08-09 EP disclosed
EP-1687279-A1 7- [4-(4-CHLOROBENZYLOXY) BENZENESULFONYL]-8-METHOXY-3-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINIUM MALEATE OR TOSYLATE AS ANTIPSYCHOTICS GLAXO GROUP LIMITED (GB) 2006-08-09 EP disclosed
EP-1687279-A1 7- [4-(4-CHLOROBENZYLOXY) BENZENESULFONYL]-8-METHOXY-3-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINIUM MALEATE OR TOSYLATE AS ANTIPSYCHOTICS GLAXO GROUP LIMITED (GB) 2006-08-09 EP disclosed
WO-2005051916-A1 7-[4-(4-CHLOROBENZYLOXY) BENZENESULFONYL]-8-METHOXY-3-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINIUM MALEATE OR TOSYLATE AS ANTIPSYCHOTICS GLAXO GROUP LIMITED (GB) 2005-06-09 WO disclosed
WO-2005051916-A1 7-[4-(4-CHLOROBENZYLOXY) BENZENESULFONYL]-8-METHOXY-3-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINIUM MALEATE OR TOSYLATE AS ANTIPSYCHOTICS GLAXO GROUP LIMITED (GB) 2005-06-09 WO disclosed
WO-2005051398-A1 7-PHENYLSULFONYL-TETRAHYDRO-3-BENZAZEPINE DERIVATIVES AS ANTIPSYCHOTIC AGENTS GLAXO GROUP LIMITED (GB) 2005-06-09 WO 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 (3 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-20070225276-A1 7-Phenylsulfonyl-Tetrahydro-3-Benzazepine Dervatives as Antipsychotic Agents HTR4, DRD4, SLC6A3 DRD2 46/4885HTR2A 448/4885REV1 4306/4885
US-20090163475-A1 CRYSTALLINE FORM OF BENZAZEPINIUM MALEATE DERIVATIVE CYP3A5, GABRA5, SLC6A13 DRD2 197/4885HTR2A 128/4885REV1 4849/4885
US-20070275948-A1 7-[4-(4-Chlorobenzyloxy)Benzenesulfonyl]-8-Methoxy-3-Methyl-2,3,4,5-Tetrahydro-1h-3-Benzazepinium Maleate Or Tosylate As antipyschotics TPMT, HTR4, HTR7 DRD2 128/4885HTR2A 70/4885REV1 4867/4885

“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.