SCHEMBL1669641

SCHEMBL1669641

c1ccc(C(c2ccccc2)(c2ccccc2)N2CCc3sccc3C2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 4/20 0.43
DRD4 P21917 3/20 0.43
DRD3 P35462 3/20 0.43
CYP2C19 P33261 3/20 0.43
ABCB11 O95342 3/20 0.43
ALDH1A1 P00352 3/20 0.43
ADRA2A P08913 2/20 0.43
CYP2B6 P20813 2/20 0.43
OPRM1 P35372 2/20 0.43
OPRK1 P41145 2/20 0.43
HTR2B P41595 2/20 0.43
KCNH2 Q12809 2/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
ADORA3 P0DMS8 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
ADRB3 P13945 1/20 0.43

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
SCHEMBL2913672 0.87 DRD1 (0.44) DRD1DRD4DRD3CYP2C19ABCB11
Lithium SCHEMBL29926457 0.86 DRD1 (0.43) DRD1DRD4DRD3CYP2C19ABCB11
SCHEMBL21113562 0.86 DRD1 (0.43) DRD1DRD4DRD3CYP2C19ABCB11
SCHEMBL6419741 0.79 DRD1 (0.40) DRD1DRD4DRD3CYP2C19ABCB11
SCHEMBL7238863 0.79 AKR1C3 (0.41) DRD1DRD4DRD3CYP2C19ABCB11
SCHEMBL30915985 0.78 MAOA (0.48) DRD1DRD4DRD3ALDH1A1ADRA2A
SCHEMBL8142884 0.76 CYP2C19 (0.44) DRD1DRD4DRD3CYP2C19ABCB11
SCHEMBL13097997 0.76 HDAC6 (0.30)
SCHEMBL29927269 0.72
SCHEMBL28921395 0.71 DRD4 (0.47) DRD1DRD4DRD3CYP2C19ABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169265-B2 Process for preparing pharmaceutical compounds and intermediate compounds EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2015-10-27 US claimed
US-20120330018-A1 PROCESS FOR PREPARING PHARMACEUTICAL COMPOUNDS AND INTERMEDIATE COMPOUNDS EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2012-12-27 US claimed
EP-2516447-A1 PROCESS FOR PREPARING PHARMACEUTICAL COMPOUNDS AND INTERMEDIATE COMPOUNDS Egis Gyógyszergyár Nyilvánosan Müködö Részvénytársaság (HU) 2012-10-31 EP claimed
WO-2011077174-A1 PROCESS FOR PREPARING PHARMACEUTICAL COMPOUNDS AND INTERMEDIATE COMPOUNDS EGIS GYÓGYSZERGYÁR NYILÁNOSAN MŰKÖDŐ RÉSZVÉNYTÁRSASÁG (HU) 2011-06-30 WO claimed
US-20100261908-A1 PROCESSES FOR THE PREPARATION OF PRASUGREL , AND ITS SALTS AND POLYMORPHS DR. REDDY'S LABORATORIES LTD. (IN) 2010-10-14 US claimed
EP-2205611-A2 PROCESSES FOR THE PREPARATION OF PRASUGREL, AND ITS SALTS AND POLYMORPHS Dr. Reddy's Laboratories Ltd. (IN) 2010-07-14 EP claimed
WO-2009062044-A2 PROCESSES FOR THE PREPARATION OF PRASUGREL, AND ITS SALTS AND POLYMORPHS DR. REDDY'S LABORATORIES LTD. (IN) 2009-05-14 WO claimed
US-9169265-B2 Process for preparing pharmaceutical compounds and intermediate compounds EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2015-10-27 US disclosed
US-9169265-B2 Process for preparing pharmaceutical compounds and intermediate compounds EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2015-10-27 US disclosed
US-9169265-B2 Process for preparing pharmaceutical compounds and intermediate compounds EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2015-10-27 US disclosed
US-9169265-B2 Process for preparing pharmaceutical compounds and intermediate compounds EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2015-10-27 US disclosed
EP-2588483-A1 IMPROVED PROCESS FOR PREPARING A PHARMACEUTICAL COMPOUND EGIS GYÓGYSZERGYÁR Nyilvánosan Müködö Részvénytársaság (HU) 2013-05-08 EP disclosed
US-20130030183-A1 PROCESS FOR PREPARING A PHARMACEUTICAL COMPOUND EGIS GYOGYSZERGYAR NYILVANOSAN MUKODO RESZVENYTARSASAG (HU) 2013-01-31 US disclosed
US-20100261908-A1 PROCESSES FOR THE PREPARATION OF PRASUGREL , AND ITS SALTS AND POLYMORPHS DR. REDDY'S LABORATORIES LTD. (IN) 2010-10-14 US disclosed
EP-2205611-A2 PROCESSES FOR THE PREPARATION OF PRASUGREL, AND ITS SALTS AND POLYMORPHS Dr. Reddy's Laboratories Ltd. (IN) 2010-07-14 EP disclosed
WO-2009066326-A2 IMPROVED PROCESS FOR THE PREPARATION OF PRASUGREL AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS MSN LABORATORIES LIMITED (IN) 2009-05-28 WO disclosed
WO-2009066326-A2 IMPROVED PROCESS FOR THE PREPARATION OF PRASUGREL AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS MSN LABORATORIES LIMITED (IN) 2009-05-28 WO disclosed
WO-2009062044-A2 PROCESSES FOR THE PREPARATION OF PRASUGREL, AND ITS SALTS AND POLYMORPHS DR. REDDY'S LABORATORIES LTD. (IN) 2009-05-14 WO disclosed
WO-2009062044-A2 PROCESSES FOR THE PREPARATION OF PRASUGREL, AND ITS SALTS AND POLYMORPHS DR. REDDY'S LABORATORIES LTD. (IN) 2009-05-14 WO disclosed
US-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials ABBOTT LABORATORIES 2002-04-25 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-20130030183-A1 PROCESS FOR PREPARING A PHARMACEUTICAL COMPOUND CYP3A5, CYP2C19, CYP4B1 DRD1 3248/4885DRD4 2028/4885DRD3 3472/4885
US-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials NQO2, NQO1, NDUFA7 DRD1 1081/4885DRD4 2105/4885DRD3 2620/4885
US-20120330018-A1 PROCESS FOR PREPARING PHARMACEUTICAL COMPOUNDS AND INTERMEDIATE COMPOUNDS CYP3A5, CYP4B1, P2RY6 DRD1 4192/4885DRD4 2270/4885DRD3 3723/4885
US-20100261908-A1 PROCESSES FOR THE PREPARATION OF PRASUGREL , AND ITS SALTS AND POLYMORPHS PFKP, CYP2C19, CYP2C9 DRD1 3680/4885DRD4 2734/4885DRD3 4066/4885

“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.